1,5-DICAFFEOYLQUINIC ACID

CAS No.
30964-13-7 ;2450-53-5 ;1884-24-8 ;117047-07-1
CCD No.
CCD00175804
Formula
C25 H24 O12
MolWeight
516.453

Basic Information

Product Name: 1,5-DICAFFEOYLQUINIC ACID
CAS: 30964-13-7 ;2450-53-5 ;1884-24-8 ;117047-07-1
English Synonyms: 1,3-DICAFFEOYLQUINIC ACID ; CYNARIN ; CYNARINE ; 1,5-DICAFFEOYLQUINIC ACID ; ISOCHLOROGENIC?ACID?A ; ISOCHLOROGENIC ACID A(3',5')
MDL Number.: MFCD00867168
H bond acceptor: 12
H bond donor: 7
Smile: c1cc(c(cc1/C=C/C(=O)OC2CC(CC(C2O)O)(C(=O)O)OC(=O)/C=C/c3ccc(c(c3)O)O)O)O
InChi: InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(24(34)35,11-19(30)23(20)33)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,33H,11-12H2,(H,34,35)/b7-3+,8-4+
InChiKey: InChIKey=YDDUMTOHNYZQPO-FCXRPNKRSA-N

Property

Comments: ASSAY BY HPLC
WITH HPLC

Safety information

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