2D Structure | |
CID | 14681481 |
Target | / |
IUPAC Name | (5S,8R,9S,10S,13S,14S)-3-ethyl-3-hydroxy-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-one |
InChI | InChI=1S/C21H34O2/c1-4-21(23)12-11-19(2)14(13-21)5-6-15-16-7-8-18(22)20(16,3)10-9-17(15)19/h14-17,23H,4-13H2,1-3H3/t14-,15-,16-,17-,19-,20-,21?/m0/s1 |
InChI Key | SPKGPDRGORWGNP-SISSWOJJSA-N |
Canonical SMILES | CCC1(CCC2(C(C1)CCC3C2CCC4(C3CCC4=O)C)C)O |
Isomeric SMILES | CCC1(CC[C@]2([C@H](C1)CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C)C)O |
Molecular Formula | C21H34O2 |
Molecular Weight | 318.5 |
synonyms | ['3-Ethyl-3-hydroxy-5alpha-androstan-17-one', 'Androstan-17-one, 3-ethyl-3-hydroxy-, (5.alpha.)-', 'SCHEMBL22090606', 'SPKGPDRGORWGNP-SISSWOJJSA-N', '3-Ethyl-3-hydroxyandrostan-17-one #'] |
From Pubchem