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3-BETA,27-DIHYDROXYOLEAN-12-EN-28-OIC-ACID
SpectraBase Compound ID JPkdPlujhQt
InChI InChI=1S/C30H48O4/c1-25(2)13-14-29(24(33)34)15-16-30(18-31)19(20(29)17-25)7-8-22-27(5)11-10-23(32)26(3,4)21(27)9-12-28(22,30)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21-,22+,23-,27-,28+,29-,30-/m0/s1
InChIKey ADBMMSFXIFGNAX-MDAIVZGXSA-N
Mol Weight 472.7 g/mol
Molecular Formula C30H48O4
Exact Mass 472.35526 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5cFnAaREqvZ
Name 3-BETA,27-DIHYDROXYOLEAN-12-EN-28-OIC-ACID
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48O4
InChI InChI=1S/C30H48O4/c1-25(2)13-14-29(24(33)34)15-16-30(18-31)19(20(29)17-25)7-8-22-27(5)11-10-23(32)26(3,4)21(27)9-12-28(22,30)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21-,22+,23-,27-,28+,29-,30-/m0/s1
InChIKey ADBMMSFXIFGNAX-MDAIVZGXSA-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 472.709 g/mol
Solvent PYRIDINE-D5
Source File Reference UWCS17929