3-O-[BETA-D-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL]-28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-FUCOPYRANOSYL-QUILLAIC-ACID

SpectraBase Compound ID	H2vOeuxfmcd
InChI	InChI=1S/C54H84O24/c1-21-30(58)33(61)38(66)44(71-21)76-41-35(63)31(59)22(2)72-46(41)78-48(70)54-16-15-49(3,4)17-24(54)23-9-10-27-50(5)13-12-29(51(6,20-56)26(50)11-14-52(27,7)53(23,8)18-28(54)57)74-47-42(37(65)36(64)40(75-47)43(68)69)77-45-39(67)34(62)32(60)25(19-55)73-45/h9,20-22,24-42,44-47,55,57-67H,10-19H2,1-8H3,(H,68,69)/t21-,22+,24?,25+,26?,27?,28+,29-,30-,31-,32-,33+,34-,35-,36-,37-,38+,39+,40-,41+,42+,44-,45-,46-,47+,50-,51-,52+,53+,54+/m0/s1
InChIKey	DRNOJFXWLIIKNP-QAPXOVKWSA-N Google Search
Mol Weight	1117.2 g/mol
Molecular Formula	C54H84O24
Exact Mass	1116.535254 g/mol

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SpectraBase Spectrum ID	EcDV4xeFNz3
Name	3-O-[BETA-D-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL]-28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-FUCOPYRANOSYL-QUILLAIC-ACID
Compound Number	3A
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C54H84O24
InChI	InChI=1S/C54H84O24/c1-21-30(58)33(61)38(66)44(71-21)76-41-35(63)31(59)22(2)72-46(41)78-48(70)54-16-15-49(3,4)17-24(54)23-9-10-27-50(5)13-12-29(51(6,20-56)26(50)11-14-52(27,7)53(23,8)18-28(54)57)74-47-42(37(65)36(64)40(75-47)43(68)69)77-45-39(67)34(62)32(60)25(19-55)73-45/h9,20-22,24-42,44-47,55,57-67H,10-19H2,1-8H3,(H,68,69)/t21-,22+,24?,25+,26?,27?,28+,29-,30-,31-,32-,33+,34-,35-,36-,37-,38+,39+,40-,41+,42+,44-,45-,46-,47+,50-,51-,52+,53+,54+/m0/s1
InChIKey	DRNOJFXWLIIKNP-QAPXOVKWSA-N
Literature Reference Author	M.A.LACAILLE-DUBOIS,B.HANQUET,Z.H.CUI,Z.C.LOU,H.WAGNER
Literature Reference Citation	PHYTOCHEM.,45,985(1997)
Literature Reference DOI	10.1016/S0031-9422(97)00087-3
Molecular Weight	1117.247 g/mol
Solvent	DMSO-D6
Source File Reference	UWPA1085