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26,27-Dinorergost-7-en-6-one, 3-(formyloxy)-24-hydroxy-, (3.beta.,5.beta.)-
SpectraBase Compound ID FWnCAAnNwBC
InChI InChI=1S/C27H42O4/c1-17(8-11-25(2,3)30)20-6-7-21-19-15-24(29)23-14-18(31-16-28)9-12-27(23,5)22(19)10-13-26(20,21)4/h15-18,20-23,30H,6-14H2,1-5H3/t17-,18+,20-,21+,22+,23+,26-,27-/m1/s1
InChIKey GJNZLSKAZGHCQS-OWOGEXKOSA-N
Mol Weight 430.6 g/mol
Molecular Formula C27H42O4
Exact Mass 430.30831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ge39tDY9fo7
Name 26,27-Dinorergost-7-en-6-one, 3-(formyloxy)-24-hydroxy-, (3.beta.,5.beta.)-
CAS Registry Number 61252-52-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H42O4
InChI InChI=1S/C27H42O4/c1-17(8-11-25(2,3)30)20-6-7-21-19-15-24(29)23-14-18(31-16-28)9-12-27(23,5)22(19)10-13-26(20,21)4/h15-18,20-23,30H,6-14H2,1-5H3/t17-,18+,20-,21+,22+,23+,26-,27-/m1/s1
InChIKey GJNZLSKAZGHCQS-OWOGEXKOSA-N
Molecular Weight 430.629 g/mol
SMILES OC(CC[C@]([C@@]1([C@@]2([C@](C=3[C@@]([C@]4(CC[C@@](C[C@]4(C(C3)=O)[H])(OC=O)[H])C)(CC2)[H])(CC1)[H])C)[H])(C)[H])(C)C
SPLASH splash10-001r-0002900000-76c56f1567d901963f63
Source of Spectrum B-29-1822-0
Synonyms (1R,2R,5S,7R,11R,14R,15R)-14-[(2R)-5-hydroxy-5-methylhexan-2-yl]-2,15-dimethyl-8-oxotetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-9-en-5-yl formate 6-Oxo-24-nor-5.beta.-cholest-7-ene-3.beta.,25-diol 3-formate
Wiley ID 1381715