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OLEAN-12-OXO-28-METHOXYCARBONYL-3-OIC_ACID_EPSILON-LACTONE
SpectraBase Compound ID Ag3JypqEiaZ
InChI InChI=1S/C31H48O5/c1-26(2)13-15-31(25(34)35-8)16-14-30(7)24(19(31)18-26)20(32)17-22-28(5)11-10-23(33)36-27(3,4)21(28)9-12-29(22,30)6/h19,21-22,24H,9-18H2,1-8H3/t19-,21-,22+,24-,28-,29+,30+,31-/m0/s1
InChIKey VSRKPIGFFCJJLB-BXLDTRCISA-N
Mol Weight 500.7 g/mol
Molecular Formula C31H48O5
Exact Mass 500.350175 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4RxeNOiCYTc
Name OLEAN-12-OXO-28-METHOXYCARBONYL-3-OIC_ACID_EPSILON-LACTONE
Compound Number 16A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H48O5
InChI InChI=1S/C31H48O5/c1-26(2)13-15-31(25(34)35-8)16-14-30(7)24(19(31)18-26)20(32)17-22-28(5)11-10-23(33)36-27(3,4)21(28)9-12-29(22,30)6/h19,21-22,24H,9-18H2,1-8H3/t19-,21-,22+,24-,28-,29+,30+,31-/m0/s1
InChIKey VSRKPIGFFCJJLB-BXLDTRCISA-N
Literature Reference Author S.QIAN,H.LI,Y.CHEN,W.ZHANG,S.YANG,Y.WU
Literature Reference Citation J.NAT.PROD.,73,1743(2010)
Literature Reference DOI 10.1021/np100064m
Molecular Weight 500.719 g/mol
Sample ID 36097
Solvent CDCl3