Progesterone 11-hemisuccinate-(2-iodohistamine)
[(8S,9S,10R,11R,13S,17S)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-11-yl] 4-[2-(1H-imidazol-5-yl)ethylamino]-4-oxobutanoate
Also Known As: His-PG|KST-1A7781|Progesterone 11-hemisuccinate-(2-iodohistamine)|Progesterone-11-hemisuccinate-(2-iodohistamine)|[(8S,9S,10R,11R,13S,17S)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-11-yl] 4-[2-(1H-imidazol-5-yl)ethylamino]-4-oxobutanoate|(11|A,14xi)-3,20-dioxopregn-4-en-11-yl 4-{[2-(1h-imidazol-5-yl)ethyl]amino}-4-oxobutanoate|A,14xi)-3,20-dioxopregn-4-en-11-yl 4-{[2-(1h-imidazol-5-yl)ethyl]amino}-4-oxobutanoate|(14xi)-3,20-Dioxopregn-4-en-11alpha-yl 4-{[2-(1H-imidazol-5-yl)ethyl]amino}-4-oxobutanoate|Pregn-4-ene-3,20-dione, 11-(4-((2-(1H-imidazol-4-yl)ethyl)amino)-1,4-dioxobutoxy)-, (11alpha)-
| Molecular Formula | C30H41N3O5 |
|---|---|
| Molecular Weight | 523.3046 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 523.3046 |
| Monoisotopic Mass | 523.3046 |
| Heavy Atoms | 38 |
| Complexity | 1010.0 |
Chemical Identifiers
| CAS Number | 7149-67-9 |
|---|---|
| SMILES | CC(=O)[C@H]1CCC2[C@@]1(C[C@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)OC(=O)CCC(=O)NCCC5=CN=CN5)C |
| InChIKey | VNERKJGHSVUODX-GHIWEOOYSA-N |
Product Overview
Progesterone 11-hemisuccinate-(2-iodohistamine) (CAS 7149-67-9), with molecular formula C30H41N3O5 and molecular weight 523.3046 g/mol. IUPAC: [(8S,9S,10R,11R,13S,17S)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-11-yl] 4-[2-(1H-imidazol-5-yl)ethylamino]-4-oxobutanoate.