17beta-Acetoxy-2,3-dihydroxyimino-5alpha-androstane

HCID 136395990
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Basic information

Standard SMILES
CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=NO)C(=NO)C[C@]4(C)[C@H]3CC[C@]12C
InChIKey
CKXOEZUIJQLVDF-FNIKZQHKSA-N
Molecular formula
C21H32N2O4
Average molar mass
376.5 g/mol

Names & identifiers

Preferred name
17beta-Acetoxy-2,3-dihydroxyimino-5alpha-androstane
IUPAC
[(5S,8R,9S,10S,13S,14S,17S)-2,3-bis(hydroxyimino)-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate

Names & synonyms

SCHEMBL8155866CKXOEZUIJQLVDF-FNIKZQHKSA-N17beta-Acetoxy-2,3-dihydroxyimino-5alpha-androstane

Database identifiers

PubChem CID
136395990

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
91.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
27

Related reactions

1 records
New reaction record

Linked notes

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