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3.alpha.-Acetoxyolean-12-en-27-oic-acid
SpectraBase Compound ID r8qg7U2bxY
InChI InChI=1S/C32H50O4/c1-20(33)36-25-12-13-30(7)23(28(25,4)5)11-14-31(8)24(30)10-9-21-22-19-27(2,3)15-16-29(22,6)17-18-32(21,31)26(34)35/h9,22-25H,10-19H2,1-8H3,(H,34,35)/t22-,23?,24+,25?,29-,30?,31+,32-/m1/s1
InChIKey IQYUEJTVDLHZDJ-POXRWEHFSA-N
Mol Weight 498.7 g/mol
Molecular Formula C32H50O4
Exact Mass 498.37091 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9CDJLN91ckG
Name 3.alpha.-Acetoxyolean-12-en-27-oic-acid
CAS Registry Number 86727-48-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C32H50O4
InChI InChI=1S/C32H50O4/c1-20(33)36-25-12-13-30(7)23(28(25,4)5)11-14-31(8)24(30)10-9-21-22-19-27(2,3)15-16-29(22,6)17-18-32(21,31)26(34)35/h9,22-25H,10-19H2,1-8H3,(H,34,35)/t22-,23?,24+,25?,29-,30?,31+,32-/m1/s1
InChIKey IQYUEJTVDLHZDJ-POXRWEHFSA-N
Literature Reference J. Org. Chem. 48, 3525 (1983).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3