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Chemical structure of 5-trans Fluprostenol

GC40284

5-trans Fluprostenol

Also known as (E)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3R)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-enyl]cyclopentyl]hept-5-enoic acid

Travoprost is the Alcon trade name for fluprostenol isopropyl ester, an F-series prostaglandin analog which has been approved for use as an ocular hypotensive drug

ChemicalCAS57968-83-9MW458.5FormulaC23H29F3O6
CAS number
57968-83-9
Molecular weight
458.5
Formula
C23H29F3O6
Solubility
DMF： 100 mg/ml,DMSO： 100 mg/ml,Ethanol： 100 mg/ml,PBS (pH 7·2)： 15 mg/ml
InChIKey
WWSWYXNVCBLWNZ-BDFMIYKPSA-N
Catalogue number
GC40284
Brand
GLPBIO
Computed properties PubChem CID 51666586 · XLogP 2.9 · TPSA 107 Ų · H-bond donors 4
XLogP
2.9
TPSA
107 Ų
H-bond donors
4
H-bond acceptors
9
Rotatable bonds
11
Heavy atoms
32

SMILES C1[C@@H]([C@@H]([C@H]([C@@H]1O)/C=C/[C@H](COC2=CC=CC(=C2)C(F)(F)F)O)C/C=C/CCCC(=O)O)O

Computed descriptors from PubChem (CID 51666586), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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