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METHYL-3-BETA-ACETOXY-D:C-FRIEDOOLEAN-8-EN-29-OATE,(METHYLACETYLBRYONOLATE)
SpectraBase Compound ID Alq0iIH7aK3
InChI InChI=1S/C33H52O4/c1-21(34)37-26-13-14-31(6)22-12-15-33(8)25-20-30(5,27(35)36-9)17-16-29(25,4)18-19-32(33,7)23(22)10-11-24(31)28(26,2)3/h24-26H,10-20H2,1-9H3/t24?,25?,26-,29?,30?,31?,32?,33?/m0/s1
InChIKey UCEMDUXYWCNPBI-XXQONKLASA-N
Mol Weight 512.8 g/mol
Molecular Formula C33H52O4
Exact Mass 512.38656 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 433rpFHxkz2
Name METHYL-3-BETA-ACETOXY-D:C-FRIEDOOLEAN-8-EN-29-OATE,(METHYLACETYLBRYONOLATE)
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H52O4
InChI InChI=1S/C33H52O4/c1-21(34)37-26-13-14-31(6)22-12-15-33(8)25-20-30(5,27(35)36-9)17-16-29(25,4)18-19-32(33,7)23(22)10-11-24(31)28(26,2)3/h24-26H,10-20H2,1-9H3/t24?,25?,26-,29?,30?,31?,32?,33?/m0/s1
InChIKey UCEMDUXYWCNPBI-XXQONKLASA-N
Literature Reference Author W.KAMISAKO,K.SUWA,K.MORIMOTO,K.ISOI
Literature Reference Citation ORG.MAGN.RES.,22,93(1984)
Literature Reference DOI 10.1002/mrc.1270220208
Molecular Weight 512.773 g/mol
Solvent CDCl3
Source File Reference UNIW7836