Molecular Identity
Fluocinolone
(6S,8S,9R,10S,11S,13S,14S,16R,17S)-6,9-difluoro-11,16,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
PubChem CID: 91488
Fluocinolone is a fluorinated steroid.
2D Structure
Properties
C21H26F2O6
Molecular Formula
412.40
Molecular Weight
g/mol
412.1697
Exact Mass
Da
1.1
XLogP
Drug-like (Lipinski: < 5)
115
TPSA
Good oral absorption (< 140 A²)
4
H-Bond Donors
8
H-Bond Acceptors
841
Complexity
SMILES
Canonical SMILES
SMILES: CC12CC(C3(C(C1CC(C2(C(=O)CO)O)O)CC(C4=CC(=O)C=CC43C)F)F)OIsomeric SMILES
SMILES: C[C@]12C[C@@H]([C@]3([C@H]([C@@H]1C[C@H]([C@@]2(C(=O)CO)O)O)C[C@@H](C4=CC(=O)C=C[C@@]43C)F)F)OSynonyms(20)
fluocinolone807-38-56-alpha-FluorotriamcinoloneCT1IX58L9S(6S,8S,9R,10S,11S,13S,14S,16R,17S)-6,9-difluoro-11,16,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-oneDTXSID001016494CHEBI:51086alpha,9-difluoro-11beta,16alpha,17,21-tetrahydroxypregna-1,4-diene-3,20-dione6-alpha,9-Difluoro-11-beta,16-alpha-17,21-tetrahydroxypregna-1,4-diene-3,20-dionePregna-1,4-diene-3,20-dione, 6-alpha,9-difluoro-11-beta,16-alpha,17,21-tetrahydroxy-(6S,8S,9R,10S,11S,13S,14S,16R,17S)-6,9-difluoro-11,16,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta(a)phenanthren-3-oneRefChem:140856DTXCID201474684212-362-9Fluocinolone Acetonide EP Impurity C
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Fluocinolone
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