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28-HYDROXY-BETA-AMIRONE;28-HYDROXYOLEAN-12-EN-3-ONE
SpectraBase Compound ID 3XJAod3xkIz
InChI InChI=1S/C30H48O2/c1-25(2)14-16-30(19-31)17-15-28(6)20(21(30)18-25)8-9-23-27(5)12-11-24(32)26(3,4)22(27)10-13-29(23,28)7/h8,21-23,31H,9-19H2,1-7H3/t21?,22?,23?,27-,28+,29+,30+/m0/s1
InChIKey LCZGVWKWRGLAFX-ZYBHZLFGSA-N
Mol Weight 440.7 g/mol
Molecular Formula C30H48O2
Exact Mass 440.365431 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kj95AKA4rK6
Name 28-HYDROXY-BETA-AMIRONE;28-HYDROXYOLEAN-12-EN-3-ONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48O2
InChI InChI=1S/C30H48O2/c1-25(2)14-16-30(19-31)17-15-28(6)20(21(30)18-25)8-9-23-27(5)12-11-24(32)26(3,4)22(27)10-13-29(23,28)7/h8,21-23,31H,9-19H2,1-7H3/t21?,22?,23?,27-,28+,29+,30+/m0/s1
InChIKey LCZGVWKWRGLAFX-ZYBHZLFGSA-N
Literature Reference Author A.YUERUEKER,J.ORJALA,O.STICHER,T.RALI
Literature Reference Citation PHYTOCHEM.,48,863(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00901-1
Molecular Weight 440.710 g/mol
Solvent CDCl3
Source File Reference UWMS1254