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METHYL-3-BETA,27-DIHYDROXYOLEAN-12-EN-28-OATE
SpectraBase Compound ID ZOX0VMTJpZ
InChI InChI=1S/C31H50O4/c1-26(2)14-15-30(25(34)35-7)16-17-31(19-32)20(21(30)18-26)8-9-23-28(5)12-11-24(33)27(3,4)22(28)10-13-29(23,31)6/h8,21-24,32-33H,9-19H2,1-7H3/t21-,22-,23+,24-,28-,29+,30-,31-/m0/s1
InChIKey QVVWCHSCIQJTGF-DZGPZUIWSA-N
Mol Weight 486.7 g/mol
Molecular Formula C31H50O4
Exact Mass 486.37091 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3Kp8Jl1cmMJ
Name METHYL-3-BETA,27-DIHYDROXYOLEAN-12-EN-28-OATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H50O4
InChI InChI=1S/C31H50O4/c1-26(2)14-15-30(25(34)35-7)16-17-31(19-32)20(21(30)18-26)8-9-23-28(5)12-11-24(33)27(3,4)22(28)10-13-29(23,31)6/h8,21-24,32-33H,9-19H2,1-7H3/t21-,22-,23+,24-,28-,29+,30-,31-/m0/s1
InChIKey QVVWCHSCIQJTGF-DZGPZUIWSA-N
Literature Reference Author Y.KASHIWADA,D.C.ZHANG,Y.P.CHEN,C.M.CHENG,H.T.CHEN,H.C.CHANG, J.J.CHANG,K.H.LEE
Literature Reference Citation J.NAT.PROD.,56,2077(1993)
Literature Reference DOI 10.1021/np50102a008
Molecular Weight 486.736 g/mol
Solvent CDCl3
Source File Reference UWCS17930