cyanidin 3-O-β-D-p-coumaroylglucoside

cyanidin 3-<i>O</i>-β-<i>D</i>-p-coumaroylglucoside




Chemical Formula:
C30H25O13
Molecular Weight:
593.52 Daltons
Monoisotopic Mass:
595.145165954 Daltons
SMILES:
C1(C=C(O)C=CC=1C=CC(=O)OCC5(OC(OC3(C(=[O+]C2(C(=C([O-])C=C([O-])C=2)C=3))C4(=CC(O)=C(O)C=C4)))C(O)C(O)C(O)5))
InChI:
1S/C30H26O13/c31-16-5-1-14(2-6-16)3-8-25(36)40-13-24-26(37)27(38)28(39)30(43-24)42-23-12-18-20(34)10-17(32)11-22(18)41-29(23)15-4-7-19(33)21(35)9-15/h1-12,24,26-28,30,37-39H,13H2,(H4-,31,32,33,34,35,36)/p-1/t24-,26-,27+,28-,30-/m1/s1
InChIKey:
QAOBEOXFSUJDJL-SHPGVJHPSA-M

Synonyms
  • cyanidin 3-O-[6"-O-(p-coumaroyl)] glucoside

Databases
MetaCyc:  CPD-16541
PubChem (CID):  102514898
ChEBI:  29560
KEGG:  C12095
Seed:  cpd08878
MetaNetX:  MNXM724520
MetaboLights:  MTBLC29560