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Stigmastan-4-ol, 3-methoxy-, (3.beta.,4.beta.,24S)-
SpectraBase Compound ID 9y3drdnZeEs
InChI InChI=1S/C30H54O2/c1-8-21(19(2)3)10-9-20(4)23-13-14-24-22-11-12-26-28(31)27(32-7)16-18-30(26,6)25(22)15-17-29(23,24)5/h19-28,31H,8-18H2,1-7H3/t20-,21+,22+,23-,24+,25+,26?,27+,28-,29-,30-/m1/s1
InChIKey UWXGIEXKHRGCMI-NJFAAMSHSA-N
Mol Weight 446.8 g/mol
Molecular Formula C30H54O2
Exact Mass 446.412381 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 73AV1HQgQHx
Name Stigmastan-4-ol, 3-methoxy-, (3.beta.,4.beta.,24S)-
Alternate Name(s) (3beta,4beta,24S)-3-methoxystigmastan-4-ol
CAS Registry Number 78148-34-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H54O2
InChI InChI=1S/C30H54O2/c1-8-21(19(2)3)10-9-20(4)23-13-14-24-22-11-12-26-28(31)27(32-7)16-18-30(26,6)25(22)15-17-29(23,24)5/h19-28,31H,8-18H2,1-7H3/t20-,21+,22+,23-,24+,25+,26?,27+,28-,29-,30-/m1/s1
InChIKey UWXGIEXKHRGCMI-NJFAAMSHSA-N
Molecular Weight 446.760 g/mol
SMILES O[C@@]1(C2[C@@]([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CC[C@@](C(C)C)(CC)[H])(C)[H])[H])[H])([H])CC2)[H])(CC[C@@]1(OC)[H])C)[H]
SPLASH splash10-01ot-0041900000-5bf349758c855d929c5b
Source of Spectrum W5-0-0-0
Wiley ID 1386847