| SpectraBase Spectrum ID |
CmUk4YtuVav |
| Name |
5.alpha.-Cholestan-19-oic acid, 2-oxo-, methyl ester, cyclic 2-(ethylene mercaptole) |
| CAS Registry Number |
28809-62-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H50O2S2 |
| InChI |
InChI=1S/C30H50O2S2/c1-20(2)7-6-8-21(3)24-11-12-25-23-10-9-22-13-16-29(33-17-18-34-29)19-30(22,27(31)32-5)26(23)14-15-28(24,25)4/h20-26H,6-19H2,1-5H3/t21-,22?,23+,24-,25+,26+,28-,30-/m1/s1 |
| InChIKey |
CEGCGSUVIQBZNY-HEFJKLLSSA-N |
| Molecular Weight |
506.848 g/mol |
| SMILES |
[C@@]12([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])([H])CCC2CCC2(C1)SCCS2)[H])C(=O)OC |
| SPLASH |
splash10-0a4j-0001980000-fa4470aea344230c4012 |
| Source of Spectrum |
O-4-379-14 |
| Synonyms |
19-Carboxmethoxy-5.alpha.-androstane-2-ethylene thioketol
Methyl (1'S,2'R,10'S,11'S,14'R,15'R)-15'-methyl-14'-[(2R)-6-methylheptan-2-yl]spiro[1,3-dithiolane-2,4'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane]-2'-carboxylate |
| Wiley ID |
1399909 |
