| CAS Number | 23017-97-2 |
| Catalog Number | AG00BJYT(AGN-PC-0O82P2) |
| Chemical Name | 3-Oxocholest-4-en-26-oic acid |
| IUPAC Name | (6R)-6-[(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-methylheptanoic acid |
| InChI | InChI=1S/C27H42O3/c1-17(6-5-7-18(2)25(29)30)22-10-11-23-21-9-8-19-16-20(28)12-14-26(19,3)24(21)13-15-27(22,23)4/h16-18,21-24H,5-15H2,1-4H3,(H,29,30)/t17-,18?,21+,22-,23+,24+,26+,27-/m1/s1 |
| InChI Key | PSXQJZDFWDKBIP-NNWQCNCGSA-N |
| MDL Number | MFCD12401151 |
| Molecular Formula | C27H42O3 |
| Molecular Weight | 414.6206 |
| SMILES | C[C@@]12[C@]([C@]3([C@@]([C@]4(C)C(CC3)=CC(=O)CC4)(CC1)[H])[H])(CC[C@@]2([C@@H](CCCC(C(O)=O)C)C)[H])[H] |
| Synonyms | delta4-dafachronic acid,
3-Oxocholest-4-en-26-oic acid,
cholest-4-en-3-one-26-oic acid,
23017-97-2,
delta4-Dafachronic acid,
Delta(4)-dafachronic acid,
Cholest-4-en-26-oic acid, 3-oxo-,
SCHEMBL1176929,
CHEBI:78686,
CTK7H2824,
PSXQJZDFWDKBIP-NNWQCNCGSA-N,
3-keto-4-cholestene-26-oic acid,
3-keto-4-cholestene-27-oic acid,
cholest-4-en-3-one-27-oic acid,
3-Oxocholest-4-en-26-oic acid #,
.delta.4-Dafachronic Acid,
|