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1-BETA,3-BETA,16-BETA-TRIHYDROXY-CHOLEST-5-EN-22-ONE-1-O-ALPHA-L-RHAMNOPYRANOSYL-16-O-[O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-BETA-D-GLUCOPYRANOSIDE]
SpectraBase Compound ID Da7XsfBGGVl
InChI InChI=1S/C45H74O17/c1-18(2)8-11-27(48)19(3)31-28(59-43-39(56)40(34(51)29(17-46)60-43)62-42-38(55)36(53)33(50)21(5)58-42)16-26-24-10-9-22-14-23(47)15-30(45(22,7)25(24)12-13-44(26,31)6)61-41-37(54)35(52)32(49)20(4)57-41/h9,18-21,23-26,28-43,46-47,49-56H,8,10-17H2,1-7H3/t19-,20-,21+,23-,24-,25+,26+,28+,29-,30-,31+,32-,33+,34-,35+,36-,37+,38-,39-,40+,41-,42+,43-,44+,45+/m1/s1
InChIKey UGEOZQNFOJXANF-SDRBXMGNSA-N
Mol Weight 887.1 g/mol
Molecular Formula C45H74O17
Exact Mass 886.492601 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HzuMljQRbxX
Name 1-BETA,3-BETA,16-BETA-TRIHYDROXY-CHOLEST-5-EN-22-ONE-1-O-ALPHA-L-RHAMNOPYRANOSYL-16-O-[O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-BETA-D-GLUCOPYRANOSIDE]
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H74O17
InChI InChI=1S/C45H74O17/c1-18(2)8-11-27(48)19(3)31-28(59-43-39(56)40(34(51)29(17-46)60-43)62-42-38(55)36(53)33(50)21(5)58-42)16-26-24-10-9-22-14-23(47)15-30(45(22,7)25(24)12-13-44(26,31)6)61-41-37(54)35(52)32(49)20(4)57-41/h9,18-21,23-26,28-43,46-47,49-56H,8,10-17H2,1-7H3/t19-,20-,21+,23-,24-,25+,26+,28+,29-,30-,31+,32-,33+,34-,35+,36-,37+,38-,39-,40+,41-,42+,43-,44+,45+/m1/s1
InChIKey UGEOZQNFOJXANF-SDRBXMGNSA-N
Literature Reference Author Y.MIMAKI,K.KAWASHIMA,T.KANMOTO,Y.SASHIDA
Literature Reference Citation PHYTOCHEM.,34,799(1993)
Literature Reference DOI 10.1016/0031-9422(93)85362-U
Molecular Weight 887.072 g/mol
Solvent C5D5N
Source File Reference UWVN6690