Showing metabocard for Luteolinidin (MMDBc0000665)

Record Information
Version1.0
StatusDetected and Quantified
Creation Date2020-12-10 18:52:15 UTC
Update Date2022-08-31 06:10:49 UTC
Metabolite IDMMDBc0000665
Metabolite Identification
Common NameLuteolinidin
DescriptionLuteolinidin belongs to the class of organic compounds known as 7-hydroxyflavonoids. These are flavonoids that bear one hydroxyl group at the C-7 position of the flavonoid skeleton. Luteolinidin has been detected, but not quantified in, corns (Zea mays). This could make luteolinidin a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on Luteolinidin.
Structure
MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for #<Metabolite:0x00007f91df724b10>


  Mrv0541 02241221462D          

 20 22  0  0  0  0            999 V2000
   -2.1434    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  5  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 11 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
  9 20  2  0  0  0  0
M  CHG  1  10   1
M  END
Download

3D MOL for #<Metabolite:0x00007f91df724b10>

HMDB0029249
     RDKit          3D
Luteolinidin
 31 33  0  0  0  0  0  0  0  0999 V2000
    4.8749   -1.4771    2.1080 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0207   -0.9169    1.1411 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6306   -0.3607    0.0465 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7795    0.2011   -0.9237 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3785    0.7644   -2.0303 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4164    0.2042   -0.8039 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5945    0.7569   -1.7599 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2233    0.7177   -1.5603 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3004    0.1392   -0.4321 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7337    0.0877   -0.2039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2092   -0.5158    0.9665 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5585   -0.5917    1.2325 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4948   -0.0655    0.3366 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8624   -0.1581    0.6356 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0332    0.5270   -0.8122 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9518    1.0589   -1.7203 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6565    0.5897   -1.0561 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5305   -0.3786    0.4578 O   0  0  0  0  0  3  0  0  0  0  0  0
    1.8358   -0.3760    0.3326 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6536   -0.9340    1.2990 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4991   -1.8965    2.9256 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7033   -0.3481   -0.0758 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8538    1.1769   -2.7520 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9667    1.2186   -2.6560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4545    1.1490   -2.3029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4947   -0.9348    1.6828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9487   -1.0558    2.1349 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4939    0.2390   -0.0475 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6082    1.4978   -2.5714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3969    1.0681   -1.9731 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2364   -1.3865    2.1821 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  1  0
  4  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15 17  2  0
  9 18  2  0
 18 19  1  0
 19 20  2  0
 20  2  1  0
 19  6  1  0
 17 10  1  0
  1 21  1  0
  3 22  1  0
  5 23  1  0
  7 24  1  0
  8 25  1  0
 11 26  1  0
 12 27  1  0
 14 28  1  0
 16 29  1  0
 17 30  1  0
 20 31  1  0
M  CHG  1  18   1
M  END
Download

3D SDF for #<Metabolite:0x00007f91df724b10>


  Mrv0541 02241221462D          

 20 22  0  0  0  0            999 V2000
   -2.1434    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  5  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 11 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
  9 20  2  0  0  0  0
M  CHG  1  10   1
M  END
> <DATABASE_ID>
MMDBc0000665

> <DATABASE_NAME>
MIME

> <SMILES>
OC1=CC2=[O+]C(=CC=C2C(O)=C1)C1=CC=C(O)C(O)=C1

> <INCHI_IDENTIFIER>
InChI=1S/C15H10O5/c16-9-6-12(18)10-2-4-14(20-15(10)7-9)8-1-3-11(17)13(19)5-8/h1-7H,(H3-,16,17,18,19)/p+1

> <INCHI_KEY>
GDNIGMNXEKGFIP-UHFFFAOYSA-O

> <FORMULA>
C15H11O5

> <MOLECULAR_WEIGHT>
271.2448

> <EXACT_MASS>
271.060648462

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_AVERAGE_POLARIZABILITY>
27.27934287380412

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
4

> <JCHEM_FORMAL_CHARGE>
1

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-1λ⁴-chromen-1-ylium

> <ALOGPS_LOGP>
2.50

> <JCHEM_LOGP>
3.3346999999999998

> <ALOGPS_LOGS>
-3.85

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
7.642200949760783

> <JCHEM_PKA_STRONGEST_ACIDIC>
6.579730432589524

> <JCHEM_PKA_STRONGEST_BASIC>
-5.857312343323941

> <JCHEM_POLAR_SURFACE_AREA>
94.06

> <JCHEM_REFRACTIVITY>
82.1322

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
4.31e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
luteolinidin

> <JCHEM_VEBER_RULE>
0

$$$$
Download

3D-SDF for #<Metabolite:0x00007f91df724b10>

HMDB0029249
     RDKit          3D
Luteolinidin
 31 33  0  0  0  0  0  0  0  0999 V2000
    4.8749   -1.4771    2.1080 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0207   -0.9169    1.1411 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6306   -0.3607    0.0465 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7795    0.2011   -0.9237 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3785    0.7644   -2.0303 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4164    0.2042   -0.8039 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5945    0.7569   -1.7599 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2233    0.7177   -1.5603 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3004    0.1392   -0.4321 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7337    0.0877   -0.2039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2092   -0.5158    0.9665 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5585   -0.5917    1.2325 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4948   -0.0655    0.3366 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8624   -0.1581    0.6356 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0332    0.5270   -0.8122 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9518    1.0589   -1.7203 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6565    0.5897   -1.0561 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5305   -0.3786    0.4578 O   0  0  0  0  0  3  0  0  0  0  0  0
    1.8358   -0.3760    0.3326 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6536   -0.9340    1.2990 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4991   -1.8965    2.9256 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7033   -0.3481   -0.0758 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8538    1.1769   -2.7520 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9667    1.2186   -2.6560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4545    1.1490   -2.3029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4947   -0.9348    1.6828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9487   -1.0558    2.1349 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4939    0.2390   -0.0475 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6082    1.4978   -2.5714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3969    1.0681   -1.9731 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2364   -1.3865    2.1821 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  1  0
  4  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15 17  2  0
  9 18  2  0
 18 19  1  0
 19 20  2  0
 20  2  1  0
 19  6  1  0
 17 10  1  0
  1 21  1  0
  3 22  1  0
  5 23  1  0
  7 24  1  0
  8 25  1  0
 11 26  1  0
 12 27  1  0
 14 28  1  0
 16 29  1  0
 17 30  1  0
 20 31  1  0
M  CHG  1  18   1
M  END
Download

PDB for #<Metabolite:0x00007f91df724b10>

HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  O   UNK     0      -4.001   2.310   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0      -2.667   1.540   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -1.334   2.310   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       0.000   1.540   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       0.000   0.000   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -1.334  -0.770   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -2.667   0.000   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      -4.001  -0.770   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0       2.667   0.000   0.000  0.00  0.00           O+1
HETATM   11  C   UNK     0       4.001  -0.770   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       5.335   0.000   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       6.668  -0.770   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0       8.002   0.000   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0       6.668  -2.310   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       5.335  -3.080   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0       5.335  -4.620   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0       4.001  -2.310   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       2.667  -3.080   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       1.334  -2.310   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3    7                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6    9                                                  
CONECT    6    5    7                                                       
CONECT    7    6    2    8                                                  
CONECT    8    7                                                            
CONECT    9    5   10   20                                                  
CONECT   10    9   11                                                       
CONECT   11   10   12   18                                                  
CONECT   12   11   13                                                       
CONECT   13   12   14   15                                                  
CONECT   14   13                                                            
CONECT   15   13   16                                                       
CONECT   16   15   17   18                                                  
CONECT   17   16                                                            
CONECT   18   16   11   19                                                  
CONECT   19   18   20                                                       
CONECT   20   19    9                                                       
MASTER        0    0    0    0    0    0    0    0   20    0   44    0
END
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3D PDB for #<Metabolite:0x00007f91df724b10>

COMPND    HMDB0029249
HETATM    1  O1  UNL     1       4.875  -1.477   2.108  1.00  0.00           O  
HETATM    2  C1  UNL     1       4.021  -0.917   1.141  1.00  0.00           C  
HETATM    3  C2  UNL     1       4.631  -0.361   0.047  1.00  0.00           C  
HETATM    4  C3  UNL     1       3.779   0.201  -0.924  1.00  0.00           C  
HETATM    5  O2  UNL     1       4.378   0.764  -2.030  1.00  0.00           O  
HETATM    6  C4  UNL     1       2.416   0.204  -0.804  1.00  0.00           C  
HETATM    7  C5  UNL     1       1.594   0.757  -1.760  1.00  0.00           C  
HETATM    8  C6  UNL     1       0.223   0.718  -1.560  1.00  0.00           C  
HETATM    9  C7  UNL     1      -0.300   0.139  -0.432  1.00  0.00           C  
HETATM   10  C8  UNL     1      -1.734   0.088  -0.204  1.00  0.00           C  
HETATM   11  C9  UNL     1      -2.209  -0.516   0.966  1.00  0.00           C  
HETATM   12  C10 UNL     1      -3.559  -0.592   1.233  1.00  0.00           C  
HETATM   13  C11 UNL     1      -4.495  -0.066   0.337  1.00  0.00           C  
HETATM   14  O3  UNL     1      -5.862  -0.158   0.636  1.00  0.00           O  
HETATM   15  C12 UNL     1      -4.033   0.527  -0.812  1.00  0.00           C  
HETATM   16  O4  UNL     1      -4.952   1.059  -1.720  1.00  0.00           O  
HETATM   17  C13 UNL     1      -2.657   0.590  -1.056  1.00  0.00           C  
HETATM   18  O5  UNL     1       0.531  -0.379   0.458  1.00  0.00           O1+
HETATM   19  C14 UNL     1       1.836  -0.376   0.333  1.00  0.00           C  
HETATM   20  C15 UNL     1       2.654  -0.934   1.299  1.00  0.00           C  
HETATM   21  H1  UNL     1       4.499  -1.897   2.926  1.00  0.00           H  
HETATM   22  H2  UNL     1       5.703  -0.348  -0.076  1.00  0.00           H  
HETATM   23  H3  UNL     1       3.854   1.177  -2.752  1.00  0.00           H  
HETATM   24  H4  UNL     1       1.967   1.219  -2.656  1.00  0.00           H  
HETATM   25  H5  UNL     1      -0.454   1.149  -2.303  1.00  0.00           H  
HETATM   26  H6  UNL     1      -1.495  -0.935   1.683  1.00  0.00           H  
HETATM   27  H7  UNL     1      -3.949  -1.056   2.135  1.00  0.00           H  
HETATM   28  H8  UNL     1      -6.494   0.239  -0.048  1.00  0.00           H  
HETATM   29  H9  UNL     1      -4.608   1.498  -2.571  1.00  0.00           H  
HETATM   30  H10 UNL     1      -2.397   1.068  -1.973  1.00  0.00           H  
HETATM   31  H11 UNL     1       2.236  -1.386   2.182  1.00  0.00           H  
CONECT    1    2   21
CONECT    2    3    3   20
CONECT    3    4   22
CONECT    4    5    6    6
CONECT    5   23
CONECT    6    7   19
CONECT    7    8    8   24
CONECT    8    9   25
CONECT    9   10   18   18
CONECT   10   11   11   17
CONECT   11   12   26
CONECT   12   13   13   27
CONECT   13   14   15
CONECT   14   28
CONECT   15   16   17   17
CONECT   16   29
CONECT   17   30
CONECT   18   19
CONECT   19   20   20
CONECT   20   31
END
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SMILES for #<Metabolite:0x00007f91df724b10>

OC1=CC2=[O+]C(=CC=C2C(O)=C1)C1=CC=C(O)C(O)=C1
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INCHI for #<Metabolite:0x00007f91df724b10>

InChI=1S/C15H10O5/c16-9-6-12(18)10-2-4-14(20-15(10)7-9)8-1-3-11(17)13(19)5-8/h1-7H,(H3-,16,17,18,19)/p+1
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Synonyms
ValueSource
2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-1-benzopyrylium(1+), 9ciHMDB
5,7,3',4'-TetrahydroxyflavyliumHMDB
LuteolidinHMDB
Molecular FormulaC15H11O5
Average Mass271.2448
Monoisotopic Mass271.060648462
IUPAC Name2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-1λ⁴-chromen-1-ylium
Traditional Nameluteolinidin
CAS Registry NumberNot Available
SMILES
OC1=CC2=[O+]C(=CC=C2C(O)=C1)C1=CC=C(O)C(O)=C1
InChI Identifier
InChI=1S/C15H10O5/c16-9-6-12(18)10-2-4-14(20-15(10)7-9)8-1-3-11(17)13(19)5-8/h1-7H,(H3-,16,17,18,19)/p+1
InChI KeyGDNIGMNXEKGFIP-UHFFFAOYSA-O