Structure Info
- Chemspace ID
- CSSS00137410481 (In-Stock Screening Compounds)
- MFCD
- MFCD20274837
- IUPAC Name
- (1S,3aS,3bR,9aR,9bS,11aS)-1-[(1S)-1,2-dihydroxyethyl]-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-7,11-dione
- Mol formula
- C21H28O4
- Mol weight
- 344 Da
- Catalog Number(s)
- AA00EGSO, AG00EGVG, AG74852, AR00EHKG, ArZ-UP484971, BBP01923, CD32000812, CFN97057, CSC137410481, FN42625, FS-8881, HY-N3194, JH379230, LN04685188, Y3316586, ZX-CY006747
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.86
- Heavy atoms count
- 25
- Rotatable bond count
- 2
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.714
- Polar surface area (Å)
- 75
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSSS00137410481
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