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30-O-ACETYL-3-BETA-(2-CARBOXYPHENYL)-CARBOXAMIDO-OLEAN-11,13(18)-DIEN

View entire compound with spectra: 1 NMR

30-O-ACETYL-3-BETA-(2-CARBOXYPHENYL)-CARBOXAMIDO-OLEAN-11,13(18)-DIEN
SpectraBase Compound ID 3iepTI4ai8H
InChI InChI=1S/C40H55NO5/c1-25(42)46-24-36(4)19-20-37(5)21-22-39(7)28(29(37)23-36)13-14-31-38(6)17-16-32(35(2,3)30(38)15-18-40(31,39)8)41-33(43)26-11-9-10-12-27(26)34(44)45/h9-14,30-32H,15-24H2,1-8H3,(H,41,43)(H,44,45)/t30-,31+,32-,36-,37?,38?,39?,40?/m0/s1
InChIKey FRJXRZVLRHSZKW-CHSNJHABSA-N
Mol Weight 629.9 g/mol
Molecular Formula C40H55NO5
Exact Mass 629.408024 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GNKnWePx7tk
Name 30-O-ACETYL-3-BETA-(2-CARBOXYPHENYL)-CARBOXAMIDO-OLEAN-11,13(18)-DIEN
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H55NO5
InChI InChI=1S/C40H55NO5/c1-25(42)46-24-36(4)19-20-37(5)21-22-39(7)28(29(37)23-36)13-14-31-38(6)17-16-32(35(2,3)30(38)15-18-40(31,39)8)41-33(43)26-11-9-10-12-27(26)34(44)45/h9-14,30-32H,15-24H2,1-8H3,(H,41,43)(H,44,45)/t30-,31+,32-,36-,37?,38?,39?,40?/m0/s1
InChIKey FRJXRZVLRHSZKW-CHSNJHABSA-N
Literature Reference Author M.TSUKAHARA,T.NISHINO,I.FURUHASHI,H.INOUE,T.SATO,H.MATSUMOTO
Literature Reference Citation CHEM.PHARM.BULL.,53,1103(2005)
Literature Reference DOI 10.1248/cpb.53.1103
Molecular Weight 629.880 g/mol
Sample ID 54175
Solvent C5D5N