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CERTONARDOSTEROL-B4;(24S)-24-METHYL-5-ALPHA-CHOLESTANE-3-BETA,4-BETA,24,24(1)-HEXOL
SpectraBase Compound ID KjMBnhUirc7
InChI InChI=1S/C28H50O6/c1-15(2)28(34,14-29)11-6-16(3)19-13-22(32)23-17-12-21(31)24-25(33)20(30)8-10-26(24,4)18(17)7-9-27(19,23)5/h15-25,29-34H,6-14H2,1-5H3/t16-,17?,18?,19?,20+,21+,22-,23?,24?,25+,26-,27-,28?/m1/s1
InChIKey UIFHHMHOQPQDQO-WRZFXIQRSA-N
Mol Weight 482.7 g/mol
Molecular Formula C28H50O6
Exact Mass 482.360739 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IBYAXfdPshX
Name CERTONARDOSTEROL-B4;(24S)-24-METHYL-5-ALPHA-CHOLESTANE-3-BETA,4-BETA,24,24(1)-HEXOL
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H50O6
InChI InChI=1S/C28H50O6/c1-15(2)28(34,14-29)11-6-16(3)19-13-22(32)23-17-12-21(31)24-25(33)20(30)8-10-26(24,4)18(17)7-9-27(19,23)5/h15-25,29-34H,6-14H2,1-5H3/t16-,17?,18?,19?,20+,21+,22-,23?,24?,25+,26-,27-,28?/m1/s1
InChIKey UIFHHMHOQPQDQO-WRZFXIQRSA-N
Literature Reference Author W.WANG,H.JANG,J.HONG,C.O.LEE,K.S.IM,S.J.BAE,J.H.JUNG
Literature Reference Citation J.NAT.PROD.,67,1654(2004)
Literature Reference DOI 10.1021/np049869b
Molecular Weight 482.701 g/mol
Solvent CD3OD
Source File Reference UWMZ6502