Dipotassium 2-(4b-fluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxohexadecahydro-6bH,8H-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl)-2-oxoethyl phosphate
Basic information
- CAS
2260-24-4- Standard SMILES
CC1(C)O[C@H]2CC3C4CC[C@H]5CC(=O)CC[C@]5(C)C4(F)[C@@H](O)C[C@]3(C)[C@]2(C(=O)COP(=O)([O-])[O-])O1.[K+].[K+]- InChIKey
HLHXSFATMSXCPL-BGTKMRBXSA-L- Molecular formula
- C24H34FK2O9P
- Average molar mass
- 594.7 g/mol
- Monoisotopic mass
- 594.1198608
Names & identifiers
- Preferred name
- Dipotassium 2-(4b-fluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxohexadecahydro-6bH,8H-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl)-2-oxoethyl phosphate
- IUPAC
- dipotassium;[2-[(4S,8S,9S,11S,13S,18S)-12-fluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosan-8-yl]-2-oxoethyl] phosphate
Names & synonyms
DTXSID90945254Dipotassium 2-(4b-fluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxohexadecahydro-6bH,8H-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl)-2-oxoethyl phosphateDipotassium 2-[(4aS,5S,6aS,6bS,9aS,12aS)-4b-fluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxohexadecahydro-6bH,8H-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl]-2-oxoethyl phosphate
Database identifiers
- CAS
2260-24-4- PubChem CID
- 160628
- DTXSID
DTXSID90945254
Properties
Computed structural properties
- Topological polar surface area
- 145 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 3
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 986
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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