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RYOBUSAPONIN-E;3-BETA-O-(BETA-D-GLUCOPYRANOSYLOXY)-LUP-20(29)-EN-28-OIC-ACID-28-O-BETA-D-GLUCOPYRANOSYLESTER
SpectraBase Compound ID Dr1hBNuCyke
InChI InChI=1S/C42H66O14/c1-19(2)20-10-15-42(37(52)56-35-31(48)28(45)27(44)22(18-43)53-35)17-16-40(6)21(26(20)42)8-9-24-39(5)13-12-25(38(3,4)23(39)11-14-41(24,40)7)54-36-32(49)29(46)30(47)33(55-36)34(50)51/h20-33,35-36,43-49H,1,8-18H2,2-7H3,(H,50,51)/t20-,21+,22+,23-,24+,25-,26+,27+,28-,29-,30-,31+,32+,33-,35-,36+,39-,40+,41+,42-/m0/s1
InChIKey NFCZZTOIVGTNPG-JZPNQEQKSA-N
Mol Weight 795.0 g/mol
Molecular Formula C42H66O14
Exact Mass 794.445257 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 43qVqsPLCgK
Name RYOBUSAPONIN-E;3-BETA-O-(BETA-D-GLUCOPYRANOSYLOXY)-LUP-20(29)-EN-28-OIC-ACID-28-O-BETA-D-GLUCOPYRANOSYLESTER
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H66O14
InChI InChI=1S/C42H66O14/c1-19(2)20-10-15-42(37(52)56-35-31(48)28(45)27(44)22(18-43)53-35)17-16-40(6)21(26(20)42)8-9-24-39(5)13-12-25(38(3,4)23(39)11-14-41(24,40)7)54-36-32(49)29(46)30(47)33(55-36)34(50)51/h20-33,35-36,43-49H,1,8-18H2,2-7H3,(H,50,51)/t20-,21+,22+,23-,24+,25-,26+,27+,28-,29-,30-,31+,32+,33-,35-,36+,39-,40+,41+,42-/m0/s1
InChIKey NFCZZTOIVGTNPG-JZPNQEQKSA-N
Literature Reference Author T.MURATA,A.SUYUKI,N.MAFUNE,E.SATO,T.MIYASE,F.YOSHIZAKI
Literature Reference Citation CHEM.PHARM.BULL.,61,134(2013)
Literature Reference DOI 10.1248/cpb.c12-00566
Molecular Weight 794.978 g/mol
Source File Reference UWBT4841