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27-Norergosta-5,7,9(11),22-tetraen-3-ol, (3.beta.,22E,24S)-
SpectraBase Compound ID CrdrgtsdW9F
InChI InChI=1S/C27H40O/c1-6-18(2)7-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h7-10,14,18-19,21,23-24,28H,6,11-13,15-17H2,1-5H3/b8-7+/t18-,19+,21-,23+,24-,26-,27+/m0/s1
InChIKey QUXDUMDXMBDNTA-OYRZKPCFSA-N
Mol Weight 380.6 g/mol
Molecular Formula C27H40O
Exact Mass 380.307916 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1tjAR3qqNVO
Name 27-Norergosta-5,7,9(11),22-tetraen-3-ol, (3.beta.,22E,24S)-
CAS Registry Number 85733-69-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H40O
InChI InChI=1S/C27H40O/c1-6-18(2)7-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h7-10,14,18-19,21,23-24,28H,6,11-13,15-17H2,1-5H3/b8-7+/t18-,19+,21-,23+,24-,26-,27+/m0/s1
InChIKey QUXDUMDXMBDNTA-OYRZKPCFSA-N
Molecular Weight 380.616 g/mol
SMILES O[C@]1(CC[C@@]2(C=3C([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](\C=C\[C@](CC)(C)[H])(C)[H])[H])[H])=CC=C2C1)C)[H]
SPLASH splash10-0w30-3594000000-cfac4523346ccee912b3
Source of Spectrum SD-1992-0-0
Synonyms (22E,24S)-24-methyl-27-norcholesta-5,7,9(11),22-tetraen-3.beta.-ol (22E,24S)-24-methyl-27-norcholesta-5,7,9(11),22-tetraen-3b-ol (22E,24S)-27-(25,24)abeo-cholesta-5,7,9(11),22-tetraen-3.beta.-ol (2S,5S,11R,14R,15R)-2,15-dimethyl-14-[(2R,3E,5S)-5-methylhept-3-en-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadeca-1(17),7,9-trien-5-ol
Wiley ID 161330