SpectraBase Spectrum ID |
EsiJ8IFTtkU |
Name |
4,10-(Epoxymethano)-10H-cyclopenta[a]phenanthrene, cholestan-19-oic acid deriv. |
CAS Registry Number |
121691-66-5 |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H44O2 |
InChI |
InChI=1S/C27H44O2/c1-17(2)7-5-8-18(3)20-12-13-21-19-10-11-23-24-9-6-15-27(23,25(28)29-24)22(19)14-16-26(20,21)4/h17-24H,5-16H2,1-4H3/t18-,19+,20-,21+,22+,23+,24?,26-,27+/m1/s1 |
InChIKey |
ZLKMRZBBPXHDGS-SJFOGZRUSA-N |
Molecular Weight |
400.647 g/mol |
SMILES |
[C@@]123C(OC([C@@]3(CC[C@]3([C@@]4(CC[C@@]([C@]4(CC[C@]13[H])C)([C@@](CCCC(C)C)(C)[H])[H])[H])[H])[H])CCC2)=O |
SPLASH |
splash10-0f6t-0893000000-32e18ed538d22742b48a |
Source of Spectrum |
KC-1989-408-11 |
Synonyms |
Cholestan-19-oic acid, 4-hydroxy-, .gamma.-lactone, (4.beta.,5.alpha.)-
(1S,2S,5R,6R,9S,10S,13R)-6-[(1R)-1,5-dimethylhexyl]-5-methyl-19-oxapentacyclo[12.3.2.0(1,13).0(2,10).0(5,9)]nonadecan-18-one
5.alpha.-cholestan-19,4-lactone |
Wiley ID |
1369733 |