Pregnenolone Carbonitrile
(VSBHRRMYCDQLJF-ZDNYCOCVSA-N)
Structure
- SMILES
- N#C[C@@H]1C[C@@H]2[C@]([C@H]1C(=O)C)(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CC[C@@H](C2)O
- Molecular Formula:
- C22H31NO2
- Molecular Weight:
- 341.487
- Log P:
- 4.2650
- Hydrogen Bond Acceptor:
- 3
- Hydrogen Bond Donor:
- 1
- TPSA:
- 61.09
- CAS Number(s):
- 1434-54-4
Synonym(s)
1.
Pregnenolone Carbonitrile
2.
PCN
3.
Pregnenolone 16 alpha-Carbonitrile
4.
Pregnenolone Carbonitrile, (3 beta)-Isomer
5.
Pregnenolone Carbonitrile, (3 beta,16 beta)-Isomer
6.
16 alpha-Carbonitrile, Pregnenolone
7.
Carbonitrile, Pregnenolone
8.
Pregnenolone 16 alpha Carbonitrile
External Link(s)
| MeSH | D011285 |
| PubChem Compound | 15032 |
| BindingDB | 50248018 |
| ChEBI | 35591 |
| CHEMBL | CHEMBL1400945 |
| IUPHAR/BPS Guide to PHARMACOLOGY | 2762 |
| KEGG | cpd:C15637 |
| Therapeutic Target Database | D01BJB |
| ZINC | 6507047 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Bone Diseases | 946392 | CTD | |
| 2 | Chemical and Drug Induced Liver Injury | 19433268 20359477 | CTD | |
| 3 | Fatty Liver | 22982774 | CTD | |
| 4 | Hepatomegaly | 7958203 | CTD | |
| 5 | Hyperglycemia | 23588309 26616219 | CTD | |
| 6 | Hypervitaminosis A | 946392 | CTD | |
| 7 | Necrosis | 22982774 | CTD |
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