Chemical Component Summary

Name2-(3,4-dihydroxy-5-methoxyphenyl)-3,5,7-trihydroxychromenium
SynonymsPetunidin
Identifiers2-[3-methoxy-4,5-bis(oxidanyl)phenyl]chromenylium-3,5,7-triol
FormulaC16 H13 O7
Molecular Weight317.27
TypeNON-POLYMER
Isomeric SMILESCOc1cc(cc(c1O)O)c2c(cc3c(cc(cc3[o+]2)O)O)O
InChIInChI=1S/C16H12O7/c1-22-14-3-7(2-11(19)15(14)21)16-12(20)6-9-10(18)4-8(17)5-13(9)23-16/h2-6H,1H3,(H4-,17,18,19,20,21)/p+1
InChIKeyAFOLOMGWVXKIQL-UHFFFAOYSA-O

Chemical Details

Formal Charge1
Atom Count36
Chiral Atom Count0
Bond Count38
Aromatic Bond Count17

Related Resource References

Resource NameReference
PubChem 441774
ChEMBL CHEMBL1275624
ChEBI CHEBI:75318