ABRUS-SAPONIN-II;3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-OLEANOLIC-ACID-28-BETA-D-GLUCOPYRANOSYLESTER

SpectraBase Compound ID	J9CB6a4Fw1J
InChI	InChI=1S/C48H76O19/c1-43(2)14-16-48(42(61)67-39-34(57)30(53)28(51)23(19-49)62-39)17-15-46(6)21(22(48)18-43)8-9-26-45(5)12-11-27(44(3,4)25(45)10-13-47(26,46)7)64-41-37(32(55)29(52)24(20-50)63-41)66-40-35(58)31(54)33(56)36(65-40)38(59)60/h8,22-37,39-41,49-58H,9-20H2,1-7H3,(H,59,60)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31-,32-,33-,34+,35+,36-,37+,39-,40-,41-,45-,46+,47+,48-/m0/s1
InChIKey	CRFOYURDKVNYOP-GCYWFABRSA-N Google Search
Mol Weight	957.1 g/mol
Molecular Formula	C48H76O19
Exact Mass	956.49808 g/mol

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SpectraBase Spectrum ID	4HKJM41OYjF
Name	ABRUS-SAPONIN-II;3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-OLEANOLIC-ACID-28-BETA-D-GLUCOPYRANOSYLESTER
Compound Number	3
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C48H76O19
InChI	InChI=1S/C48H76O19/c1-43(2)14-16-48(42(61)67-39-34(57)30(53)28(51)23(19-49)62-39)17-15-46(6)21(22(48)18-43)8-9-26-45(5)12-11-27(44(3,4)25(45)10-13-47(26,46)7)64-41-37(32(55)29(52)24(20-50)63-41)66-40-35(58)31(54)33(56)36(65-40)38(59)60/h8,22-37,39-41,49-58H,9-20H2,1-7H3,(H,59,60)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31-,32-,33-,34+,35+,36-,37+,39-,40-,41-,45-,46+,47+,48-/m0/s1
InChIKey	CRFOYURDKVNYOP-GCYWFABRSA-N
Literature Reference Author	C.M.MA,N.NAKAMURA,M.HATTORI
Literature Reference Citation	CHEM.PHARM.BULL.,46,982(1998)
Literature Reference DOI	10.1248/cpb.46.982
Molecular Weight	957.120 g/mol
Solvent	C5D5N
Source File Reference	UWMS6481