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3B-(PARA-HYDROXY-TRANS-CINNAMOYLOXY)-OLEAN-12-EN-28-OIC_ACID
SpectraBase Compound ID C7d5iFK9rdv
InChI InChI=1S/C39H54O5/c1-34(2)20-22-39(33(42)43)23-21-37(6)27(28(39)24-34)13-14-30-36(5)18-17-31(35(3,4)29(36)16-19-38(30,37)7)44-32(41)15-10-25-8-11-26(40)12-9-25/h8-13,15,28-31,40H,14,16-24H2,1-7H3,(H,42,43)/b15-10+/t28?,29?,30?,31-,36-,37+,38+,39-/m0/s1
InChIKey PSKOYUFGDWKJBO-KCMQMUBWSA-N
Mol Weight 602.9 g/mol
Molecular Formula C39H54O5
Exact Mass 602.397125 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Q55WWnDD1w
Name 3B-(PARA-HYDROXY-TRANS-CINNAMOYLOXY)-OLEAN-12-EN-28-OIC_ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H54O5
InChI InChI=1S/C39H54O5/c1-34(2)20-22-39(33(42)43)23-21-37(6)27(28(39)24-34)13-14-30-36(5)18-17-31(35(3,4)29(36)16-19-38(30,37)7)44-32(41)15-10-25-8-11-26(40)12-9-25/h8-13,15,28-31,40H,14,16-24H2,1-7H3,(H,42,43)/b15-10+/t28?,29?,30?,31-,36-,37+,38+,39-/m0/s1
InChIKey PSKOYUFGDWKJBO-KCMQMUBWSA-N
Literature Reference Author L.M.CARVALHO,J.SEITA
Literature Reference Citation PLANTA.MED.,59,369(1993)
Literature Reference DOI 10.1055/s-2006-959704
Molecular Weight 602.855 g/mol
Solvent CDCl3
Source File Reference UIAP485