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3-BETA,27-DIHYDROXYOLEAN-12-EN-28-OIC-ACID

View entire compound with spectra: 6 NMR

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 AzcmHPH3N9C
Name MYRICEROL
Compound Number 7
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 K.SAKURAWI,F.YASUDA,T.TOZYO,M.NAKAMURA,T.SATO,J.KIKUCHI,Y.TE RUI,Y.IKENISHI,T.IW
Literature Reference Citation CHEM.PHARM.BULL.,44,343(1996)
Literature Reference DOI 10.1248/cpb.44.343
Molecular Weight 472.709 g/mol
Solvent CDCl3
Source File Reference UWLU31658