SAPONIN-2;3-BETA-O-[BETA-D-RHAMNOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPY-RANOSYL-(1->4)-[O-BETA-D-GLUCOPYRANOSYL]-ALPHA-L-ARABINOPYRANOSYL]-16-ALPHA-HY-

SpectraBase Compound ID	1bhn9VeLKti
InChI	InChI=1S/C53H88O21/c1-23-32(57)36(61)39(64)43(68-23)74-42-38(63)34(59)25(20-55)70-46(42)71-26-21-66-45(41(35(26)60)73-44-40(65)37(62)33(58)24(19-54)69-44)72-31-11-12-49(6)27(48(31,4)5)9-13-50(7)28(49)10-14-53-29-17-47(2,3)15-16-52(29,22-67-53)30(56)18-51(50,53)8/h23-46,54-65H,9-22H2,1-8H3/t23-,24-,25-,26+,27?,28?,29?,30-,31+,32-,33-,34-,35+,36+,37+,38+,39+,40-,41-,42-,43+,44+,45+,46+,49+,50-,51+,52-,53+/m1/s1
InChIKey	MIBQGVWGYOOZBJ-OTJHBXTKSA-N Google Search
Mol Weight	1061.3 g/mol
Molecular Formula	C53H88O21
Exact Mass	1060.58181 g/mol

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SpectraBase Spectrum ID	DyQtjdSj5Sv
Name	SAPONIN-2;3-BETA-O-[BETA-D-RHAMNOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPY-RANOSYL-(1->4)-[O-BETA-D-GLUCOPYRANOSYL]-ALPHA-L-ARABINOPYRANOSYL]-16-ALPHA-HY-
Compound Number	2
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C53H88O21
InChI	InChI=1S/C53H88O21/c1-23-32(57)36(61)39(64)43(68-23)74-42-38(63)34(59)25(20-55)70-46(42)71-26-21-66-45(41(35(26)60)73-44-40(65)37(62)33(58)24(19-54)69-44)72-31-11-12-49(6)27(48(31,4)5)9-13-50(7)28(49)10-14-53-29-17-47(2,3)15-16-52(29,22-67-53)30(56)18-51(50,53)8/h23-46,54-65H,9-22H2,1-8H3/t23-,24-,25-,26+,27?,28?,29?,30-,31+,32-,33-,34-,35+,36+,37+,38+,39+,40-,41-,42-,43+,44+,45+,46+,49+,50-,51+,52-,53+/m1/s1
InChIKey	MIBQGVWGYOOZBJ-OTJHBXTKSA-N
Literature Reference Author	V.R.HEGDE,J.SILVER,M.G.PATEL,R.BRYANT,J.PAI,P.R.DAS,M.S.PUAR ,P.A.COX
Literature Reference Citation	J.NAT.PROD.,58,1492(1995)
Literature Reference DOI	10.1021/np50124a003
Molecular Weight	1061.269 g/mol
Solvent	C5D5N
Source File Reference	UWRU615