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HOMAXISTEROL_A2;(22-E,24-S)-6-O-BUTYL-24-METHYLCHOLESTA-7,22-DIENE-3-BETA,5-ALPHA,6-BETA-TRIOL
SpectraBase Compound ID 4n4Y0A5zSey
InChI InChI=1S/C32H54O3/c1-8-9-18-35-29-19-25-27-13-12-26(23(5)11-10-22(4)21(2)3)30(27,6)16-15-28(25)31(7)17-14-24(33)20-32(29,31)34/h10-11,19,21-24,26-29,33-34H,8-9,12-18,20H2,1-7H3/b11-10+/t22-,23+,24-,26+,27?,28?,29+,30+,31+,32-/m0/s1
InChIKey REDLNGNAWVGTOL-OBGQKGBZSA-N
Mol Weight 486.8 g/mol
Molecular Formula C32H54O3
Exact Mass 486.407296 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kd2FwDIbdsG
Name HOMAXISTEROL_A2;(22-E,24-S)-6-O-BUTYL-24-METHYLCHOLESTA-7,22-DIENE-3-BETA,5-ALPHA,6-BETA-TRIOL
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H54O3
InChI InChI=1S/C32H54O3/c1-8-9-18-35-29-19-25-27-13-12-26(23(5)11-10-22(4)21(2)3)30(27,6)16-15-28(25)31(7)17-14-24(33)20-32(29,31)34/h10-11,19,21-24,26-29,33-34H,8-9,12-18,20H2,1-7H3/b11-10+/t22-,23+,24-,26+,27?,28?,29+,30+,31+,32-/m0/s1
InChIKey REDLNGNAWVGTOL-OBGQKGBZSA-N
Literature Reference Author T.A.MANSOOR,J.HONG,C.O.LEE,S.J.BAE,K.S.IM,J.H.JUNG
Literature Reference Citation J.NAT.PROD.,68,331(2005)
Literature Reference DOI 10.1021/np0496690
Molecular Weight 486.779 g/mol
Solvent CD3OD
Source File Reference UWMZ7679