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Spiro[3H-cyclopenta[a]phenanthrene-3,1'-cyclopropane], spiro[androstane-3,1'-cyclopropane]-2'-carboxylic acid deriv.
SpectraBase Compound ID GFLO2aS2Zjg
InChI InChI=1S/C26H37NO4/c1-16(28)31-21-8-7-19-18-6-5-17-13-25(14-26(25,15-27)22(29)30-4)12-11-23(17,2)20(18)9-10-24(19,21)3/h17-21H,5-14H2,1-4H3/t17-,18-,19-,20-,21-,23-,24-,25?,26?/m0/s1
InChIKey BEWGHYQUJKWCEA-NGLGIRJHSA-N
Mol Weight 427.6 g/mol
Molecular Formula C26H37NO4
Exact Mass 427.272259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Br4qqd4cuP4
Name Spiro[3H-cyclopenta[a]phenanthrene-3,1'-cyclopropane], spiro[androstane-3,1'-cyclopropane]-2'-carboxylic acid deriv.
CAS Registry Number 68352-22-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H37NO4
InChI InChI=1S/C26H37NO4/c1-16(28)31-21-8-7-19-18-6-5-17-13-25(14-26(25,15-27)22(29)30-4)12-11-23(17,2)20(18)9-10-24(19,21)3/h17-21H,5-14H2,1-4H3/t17-,18-,19-,20-,21-,23-,24-,25?,26?/m0/s1
InChIKey BEWGHYQUJKWCEA-NGLGIRJHSA-N
Molecular Weight 427.585 g/mol
SMILES C1(C2(C[C@@]3(CC[C@]4([C@@]5(CC[C@@]([C@]5(CC[C@@]4([C@]3(CC2)C)[H])C)(OC(=O)C)[H])[H])[H])[H])C1)(C(=O)OC)C#N
SPLASH splash10-066r-0559300000-5f637b7db03e133c6a1c
Source of Spectrum K-111-3103-0
Synonyms Spiro[androstane-3,1'-cyclopropane]-2'-carboxylic acid, 17-(acetyloxy)-2'-cyano-, methyl ester, (5.alpha.,17.beta.)- Methyl (1'S,2'S,7'S,10'R,11'S,14'S,15'S)-14'-(acetyloxy)-3-cyano-2',15'-dimethylspiro[cyclopropane-1,5'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane]-3-carboxylate Methyl ester of 17.beta.-acetoxy-2'-cyan-spiro(5.alpha.-androstane-3,1'-cyclopropane)-2'-carboxylic acid
Wiley ID 1380445