KAEMPFEROL 3-O-BETA-D-GLUCURONIDE

CAS No.
22688-78-4
CCD No.
CCD04333474
Formula
C21 H18 O12
MolWeight
462.361

Basic Information

Product Name: KAEMPFEROL 3-O-BETA-D-GLUCURONIDE
CAS: 22688-78-4
English Synonyms: KAEMPFEROL 3-O-BETA-D-GLUCURONIDE ; 5,7-DIHYDROXY-2-(4-HYDROXYPHENYL)-4-OXO-4H-CHROMEN-3-YL-D-GLUCOPYRANOSIDURONIC ACID ; KAEMPFEROL-3-BETA-O-GLUCURONIDE
MDL Number.: MFCD18632526
H bond acceptor: 12
H bond donor: 7
Smile: c1cc(ccc1c2c(c(=O)c3c(cc(cc3o2)O)O)O[C@@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O
InChi: InChI=1S/C21H18O12/c22-8-3-1-7(2-4-8)17-18(13(25)12-10(24)5-9(23)6-11(12)31-17)32-21-16(28)14(26)15(27)19(33-21)20(29)30/h1-6,14-16,19,21-24,26-28H,(H,29,30)/t14-,15-,16+,19-,21-/m0/s1
InChiKey: InChIKey=FNTJVYCFNVUBOL-GGTBVAQXSA-N

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