1,3,4,5-Tetracaffeoylquinic acid
InChI: InChI=1/C43H36O18/c44-27-9-1-23(17-31(27)48)5-13-37(52)58-35-21-43(42(56)57,61-40(55)16-8-26-4-12-30(47)34(51)20-26)22-36(59-38(53)14-6-24-2-10-28(45)32(49)18-24)41(35)60-39(54)15-7-25-3-11-29(46)33(50)19-25/h1-20,35-36,41,44-51H,21-22H2,(H,56,57)/b13-5+,14-6+,15-7+,16-8+/t35-,36-,41-,43+/m1/s1
InChIKey: InChIKey=VTHDRBWIVRFQKI-ATQMDXCCBO
SMILES: OC(=O)[C@]1(C[C@@H](OC(=O)\C=C\C2=CC(O)=C(O)C=C2)[C@H](OC(=O)\C=C\C3=CC(O)=C(O)C=C3)[C@@H](C1)OC(=O)\C=C\C4=CC(O)=C(O)C=C4)OC(=O)\C=C\C5=CC(O)=C(O)C=C5
Names:
1,3,4,5-Tetracaffeoylquinic acid
1,3,4,5-tetracaffeoylquinic acid
Registries:
PubChem CID 5281799
ChEBI 512
Kegg C10500
PubChem ID 12683
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