ALPHA-HEDERIN-28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-ESTER;3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL]-3-BET

SpectraBase Compound ID	IYXIKzj0AmF
InChI	InChI=1S/C53H86O21/c1-23-32(57)36(61)39(64)43(68-23)72-41-34(59)27(56)21-67-45(41)71-31-12-13-49(5)29(50(31,6)22-55)11-14-52(8)30(49)10-9-25-26-19-48(3,4)15-17-53(26,18-16-51(25,52)7)47(66)74-46-42(38(63)35(60)28(20-54)70-46)73-44-40(65)37(62)33(58)24(2)69-44/h9,23-24,26-46,54-65H,10-22H2,1-8H3/t23-,24-,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-/m0/s1
InChIKey	CLZYWRUNZCUSGT-RLADQYJBSA-N Google Search
Mol Weight	1059.2 g/mol
Molecular Formula	C53H86O21
Exact Mass	1058.56616 g/mol

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SpectraBase Spectrum ID	48pTPphWskV
Name	ALPHA-HEDERIN-28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL]-ESTER;3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL]-3-BET
Compound Number	2
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C53H86O21
InChI	InChI=1S/C53H86O21/c1-23-32(57)36(61)39(64)43(68-23)72-41-34(59)27(56)21-67-45(41)71-31-12-13-49(5)29(50(31,6)22-55)11-14-52(8)30(49)10-9-25-26-19-48(3,4)15-17-53(26,18-16-51(25,52)7)47(66)74-46-42(38(63)35(60)28(20-54)70-46)73-44-40(65)37(62)33(58)24(2)69-44/h9,23-24,26-46,54-65H,10-22H2,1-8H3/t23-,24-,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-/m0/s1
InChIKey	CLZYWRUNZCUSGT-RLADQYJBSA-N
Literature Reference Author	C.LAVAUD,M.L.CRUBLET,I.POUNY,M.LITAUDON,T.SEVENET
Literature Reference Citation	PHYTOCHEM.,57,469(2001)
Literature Reference DOI	10.1016/S0031-9422(01)00063-2
Molecular Weight	1059.253 g/mol
Solvent	CD3OD
Source File Reference	UWVN2232