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3-Oxo-olean-12-en-29-oic Acid
SpectraBase Compound ID 7RpUPLoUG7j
InChI InChI=1S/C30H46O3/c1-25(2)21-10-13-30(7)22(28(21,5)12-11-23(25)31)9-8-19-20-18-27(4,24(32)33)15-14-26(20,3)16-17-29(19,30)6/h8,20-22H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,26+,27+,28-,29+,30+/m0/s1
InChIKey CGZZFWMLSVHLFZ-FUQFICMISA-N
Mol Weight 454.7 g/mol
Molecular Formula C30H46O3
Exact Mass 454.344695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KY1IDDRF4uw
Name 3-OXO-OLEAN-12-EN-29-OIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H46O3
InChI InChI=1S/C30H46O3/c1-25(2)21-10-13-30(7)22(28(21,5)12-11-23(25)31)9-8-19-20-18-27(4,24(32)33)15-14-26(20,3)16-17-29(19,30)6/h8,20-22H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,26+,27+,28-,29+,30+/m0/s1
InChIKey CGZZFWMLSVHLFZ-FUQFICMISA-N
Literature Reference Author N.KANEDA,J.M.PEZZUTO,A.D.KINGHORN,N.R.FARNSWORTH,T.SANTISUK, P.TUCHINDA,J.UDACHAC
Literature Reference Citation J.NAT.PROD.,55,654(1992)
Literature Reference DOI 10.1021/np50083a016
Molecular Weight 454.693 g/mol
Solvent CDCl3
Source File Reference UWCS4171