CID 9561809
Basic information
- CAS
28444-84-0- Standard SMILES
C[C@H](/C=N/O)[C@H]1CC[C@H]2[C@@H]3CCC4=C/C(=N/O)CC[C@]4(C)[C@H]3CC[C@]12C- InChIKey
LPFFRMGUWCHBIL-IHUQUXRCSA-N- Molecular formula
- C22H34N2O2
- Average molar mass
- 358.5 g/mol
- Monoisotopic mass
- 358.26202833
Names & identifiers
- Preferred name
- CID 9561809
- IUPAC
- (NE)-N-[(2S)-2-[(3E,8S,9S,10R,13S,14S,17R)-3-hydroxyimino-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]propylidene]hydroxylamine
Names & synonyms
28444-84-0(NE)-N-[(2S)-2-[(3E,8S,9S,10R,13S,14S,17R)-3-hydroxyimino-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]propylidene]hydroxylamineNSC-75531NSC75531
Database identifiers
- CAS
28444-84-0- PubChem CID
- 9561809
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 65.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 655
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Compound notes
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