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OLEANOLIC-ACID-3-O-GLUTARATE

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OLEANOLIC-ACID-3-O-GLUTARATE
SpectraBase Compound ID 96OrfUOj2Zt
InChI InChI=1S/C35H54O6/c1-30(2)17-19-35(29(39)40)20-18-33(6)22(23(35)21-30)11-12-25-32(5)15-14-26(41-28(38)10-8-9-27(36)37)31(3,4)24(32)13-16-34(25,33)7/h11,23-26H,8-10,12-21H2,1-7H3,(H,36,37)(H,39,40)/t23-,24-,25+,26-,32-,33+,34+,35-/m0/s1
InChIKey NVEQPGMRTSPJGZ-FVWYBJPTSA-N
Mol Weight 570.8 g/mol
Molecular Formula C35H54O6
Exact Mass 570.392039 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KFqGFfVECsQ
Name OLEANOLIC-ACID-3-O-GLUTARATE
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H54O6
InChI InChI=1S/C35H54O6/c1-30(2)17-19-35(29(39)40)20-18-33(6)22(23(35)21-30)11-12-25-32(5)15-14-26(41-28(38)10-8-9-27(36)37)31(3,4)24(32)13-16-34(25,33)7/h11,23-26H,8-10,12-21H2,1-7H3,(H,36,37)(H,39,40)/t23-,24-,25+,26-,32-,33+,34+,35-/m0/s1
InChIKey NVEQPGMRTSPJGZ-FVWYBJPTSA-N
Literature Reference Author Y.KASHIWADA,H.K.WANG,T.NAGAO,S.KITANAKA,I.YASUDA,T.FUJIOKA,T .YAMAGISHI,L.M.COSEN
Literature Reference Citation J.NAT.PROD.,61,1090(1998)
Literature Reference DOI 10.1021/np9800710
Molecular Weight 570.810 g/mol
Solvent CDCl3
Source File Reference UWCP2117