QUILAIC-ACID-3-O-BETA-D-XYLOPYRANOSYL-(1->3)-[BETA-D-GALACTOPYRANOSYL-(1->2)]-BETA-D-GLUCURONOPYRANOSIDE

SpectraBase Compound ID	IewquxDfFxh
InChI	InChI=1S/C47H72O20/c1-42(2)13-14-47(41(60)61)21(15-42)20-7-8-25-43(3)11-10-27(44(4,19-49)24(43)9-12-45(25,5)46(20,6)16-26(47)51)64-40-36(67-39-32(56)30(54)29(53)23(17-48)63-39)34(33(57)35(66-40)37(58)59)65-38-31(55)28(52)22(50)18-62-38/h7,19,21-36,38-40,48,50-57H,8-18H2,1-6H3,(H,58,59)(H,60,61)/t21?,22-,23+,24?,25?,26+,27-,28+,29+,30-,31-,32+,33+,34+,35+,36-,38+,39-,40-,43-,44-,45+,46+,47+/m0/s1
InChIKey	KUOJCJXXMJCHIN-YXNAJLAQSA-N Google Search
Mol Weight	957.1 g/mol
Molecular Formula	C47H72O20
Exact Mass	956.461695 g/mol

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SpectraBase Spectrum ID	Yjae7otaxx
Name	QUILAIC-ACID-3-O-BETA-D-XYLOPYRANOSYL-(1->3)-[BETA-D-GALACTOPYRANOSYL-(1->2)]-BETA-D-GLUCURONOPYRANOSIDE
Compound Number	2
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C47H72O20
InChI	InChI=1S/C47H72O20/c1-42(2)13-14-47(41(60)61)21(15-42)20-7-8-25-43(3)11-10-27(44(4,19-49)24(43)9-12-45(25,5)46(20,6)16-26(47)51)64-40-36(67-39-32(56)30(54)29(53)23(17-48)63-39)34(33(57)35(66-40)37(58)59)65-38-31(55)28(52)22(50)18-62-38/h7,19,21-36,38-40,48,50-57H,8-18H2,1-6H3,(H,58,59)(H,60,61)/t21?,22-,23+,24?,25?,26+,27-,28+,29+,30-,31-,32+,33+,34+,35+,36-,38+,39-,40-,43-,44-,45+,46+,47+/m0/s1
InChIKey	KUOJCJXXMJCHIN-YXNAJLAQSA-N
Literature Reference Author	M.LARHSINI,A.MARSTON,K.HOSTETTMANN
Literature Reference Citation	FITOTERAPIA,74,237(2003)
Literature Reference DOI	10.1016/S0367-326X(03)00031-5
Molecular Weight	957.077 g/mol
Solvent	C5D5N
Source File Reference	UWVN4180