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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H33F3O6
Molecular Weight 498.5318
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 15-KETO TRAVOPROST

SMILES

CC(C)OC(=O)CCC\C=C/C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1\C=C\C(=O)COC2=CC(=CC=C2)C(F)(F)F

InChI

InChIKey=KSDDYCRRTVADFZ-OHDKTVHDSA-N
InChI=1S/C26H33F3O6/c1-17(2)35-25(33)11-6-4-3-5-10-21-22(24(32)15-23(21)31)13-12-19(30)16-34-20-9-7-8-18(14-20)26(27,28)29/h3,5,7-9,12-14,17,21-24,31-32H,4,6,10-11,15-16H2,1-2H3/b5-3-,13-12+/t21-,22-,23+,24-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
15-KETO TRAVOPROST
Common Name English
(Z)-ISOPROPYL 7-((1R,2R,3R,5S)-3,5-DIHYDROXY-2-((E)-3-OXO-4-(3-(TRIFLUOROMETHYL)PHENOXY)BUT-1-EN-1-YL)CYCLOPENTYL)HEPT-5-ENOATE
Systematic Name English
TRAVOPROST IMPURITY, 15-KETO DERIVATIVE- [USP IMPURITY]
Common Name English
(5Z,13E)-(9S,11R)-9,11,-DIHYDROXY-15-OXO-16-(M-TRIFLUOROMETHYLPHENOXY)-17,18,19,20-TETRANOR-5,13-PROSTADIENOIC ACID, ISOPROPYL ESTER
Common Name English
15-OXO TRAVOPROST
Common Name English
5-HEPTENOIC ACID, 7-((1R,2R,3R,5S)-3,5-DIHYDROXY-2-((1E)-3-OXO-4-(3-(TRIFLUOROMETHYL)PHENOXY)-1-BUTEN-1-YL)CYCLOPENTYL)-, 1-METHYLETHYL ESTER, (5Z)-
Systematic Name English
Code System Code Type Description
CAS
404830-45-1
Created by admin on Sat Dec 16 09:16:46 GMT 2023 , Edited by admin on Sat Dec 16 09:16:46 GMT 2023
PRIMARY
FDA UNII
4U2P9U9Z66
Created by admin on Sat Dec 16 09:16:46 GMT 2023 , Edited by admin on Sat Dec 16 09:16:46 GMT 2023
PRIMARY
PUBCHEM
10207075
Created by admin on Sat Dec 16 09:16:46 GMT 2023 , Edited by admin on Sat Dec 16 09:16:46 GMT 2023
PRIMARY