quercetin 3-O-(3',6"-O-di-p-coumaroyl)-glucoside
O-di-p-coumaroyl)-glucoside" height="280 px">
Chemical Formula:
C39H32O16
Molecular Weight:
756.672 Daltons
Monoisotopic Mass:
756.1690349808 Daltons
SMILES:
C(OCC5(OC(OC3(C(=O)C1(C(=CC(O)=CC(O)=1)OC(C2(C=C(O)C(O)=CC=2))=3)))C(O)C(OC(=O)C=CC4(C=CC(O)=CC=4))C(O)5))(=O)C=CC6(C=CC(O)=CC=6)
InChI:
1S/C39H32O16/c40-22-8-1-19(2-9-22)5-13-30(46)51-18-29-33(48)37(54-31(47)14-6-20-3-10-23(41)11-4-20)35(50)39(53-29)55-38-34(49)32-27(45)16-24(42)17-28(32)52-36(38)21-7-12-25(43)26(44)15-21/h1-17,29,33,35,37,39-45,48,50H,18H2/b13-5+,14-6+/t29-,33-,35-,37+,39+/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-14984
PubChem (CID):
23265223
MetaNetX:
MNXM114721