Basic information
- CAS
98804-55-8- Standard SMILES
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CC[C@@H]2OS(=O)(=O)O- InChIKey
SKZMVWBZTQNCKW-IZPLOLCNSA-N- Molecular formula
- C18H26O5S
- Average molar mass
- 354.5 g/mol
- Monoisotopic mass
- 354.1500951
Names & identifiers
- Preferred name
- Nandrolone hydrogen sulfate
- IUPAC
- [(8R,9S,10R,13S,14S,17S)-13-methyl-3-oxo-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] hydrogen sulfate
Names & synonyms
Nandrolone hydrogen sulfateNandrolone sulfateUNII-2S202OX23O2S202OX23O98804-55-8Estr-4-en-3-one, 17-(sulfooxy)-, (17beta)-Estr-4-en-3-one, 17beta-hydroxy-, hydrogen sulfate19-nortestosterone sulfateSCHEMBL15901533DTXSID00243819DB146243-Oxoestr-4-en-17beta-yl hydrogen sulfate
Show more names
Q27255527ESTR-4-EN-3-ONE, 17-(SULFOOXY)-, (17.BETA.)-ESTR-4-EN-3-ONE, 17.BETA.-HYDROXY-, HYDROGEN SULFATE
Database identifiers
- CAS
98804-55-8- PubChem CID
- 3085201
- DTXSID
DTXSID00243819- UNII
- 2S202OX23O
- Nikkaji
- J397.313A
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 89.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 676
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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