5-Hydroxy-6b-(hydroxyacetyl)-4a,6a,8-trimethyl-3,4,4a,4b,5,6,6a,6b,9a,10,10a,10b,11,12-tetradecahydro-2h-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-2-one
Basic information
- CAS
21269-11-4- Standard SMILES
CC1=NC2(C(=O)CO)C(CC3C4CCC5=CC(=O)CCC5(C)C4C(O)CC32C)O1- InChIKey
FFCGTEHFZJEQAV-UHFFFAOYSA-N- Molecular formula
- C23H31NO5
- Average molar mass
- 401.5 g/mol
- Monoisotopic mass
- 401.22022309
Names & identifiers
- Preferred name
- 5-Hydroxy-6b-(hydroxyacetyl)-4a,6a,8-trimethyl-3,4,4a,4b,5,6,6a,6b,9a,10,10a,10b,11,12-tetradecahydro-2h-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-2-one
- IUPAC
- 11-hydroxy-8-(2-hydroxyacetyl)-6,9,13-trimethyl-5-oxa-7-azapentacyclo[10.8.0.02,9.04,8.013,18]icosa-6,17-dien-16-one
Names & synonyms
21269-11-45-hydroxy-6b-(hydroxyacetyl)-4a,6a,8-trimethyl-3,4,4a,4b,5,6,6a,6b,9a,10,10a,10b,11,12-tetradecahydro-2h-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-2-oneDTXSID20943728NS00050083
Database identifiers
- CAS
21269-11-4- PubChem CID
- 89473
- DTXSID
DTXSID20943728- EC Number
- 244-305-9
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 96.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 848
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Compound notes
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