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Substance Name: 15-Epi travoprost
RN: 1420791-14-5
UNII: NDD23J941F
InChIKey: MKPLKVHSHYCHOC-AURHPGDUSA-N

Molecular Formula

  • C26-H35-F3-O6

Molecular Weight

  • 500.5505
 
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Names and Synonyms

Name of Substance

  • 15-Epi travoprost

Synonyms

  • (5Z,13E)-(9S,11R,15S)-9,11,15-Trihydroxy-16-(m-trifluoromethylphenoxy)-17,18,19,20-tetranor-5,13-prostadienoic acid, isopropyl ester
  • (Z)-Isopropyl 7-((1R,2R,3R,5S)-3,5-dihydroxy-2-((S,E)-3-hydroxy-4-(3-(trifluoromethyl)phenoxy)but-1-en-1-yl)cyclopentyl)hept-5-enoate
  • 15-Epi travoprost
  • 5-Heptenoic acid, 7-((1R,2R,3R,5S)-3,5-dihydroxy-2-((1E,3S)-3-hydroxy-4-(3-(trifluoromethyl)phenoxy)-1-buten-1-yl)cyclopentyl)-, 1-methylethyl ester, (5Z)-
  • Travoprost impurity, 15-epi diastereomer- [USP]
  • UNII-NDD23J941F

Registry Numbers

CAS Registry Number

  • 1420791-14-5

FDA UNII

  • NDD23J941F

System Generated Number

  • 1420791145

Structure Descriptors

InChI

1S/C26H35F3O6/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/h3,5,7-9,12-14,17,19,21-24,30-32H,4,6,10-11,15-16H2,1-2H3/b5-3-,13-12+/t19-,21+,22+,23-,24+/m0/s1

InChIKey

MKPLKVHSHYCHOC-AURHPGDUSA-N

Smiles

CC(C)OC(=O)CCC/C=C\C[C@H]1[C@H](C[C@H]([C@@H]1/C=C/[C@@H](COc2cccc(c2)C(F)(F)F)O)O)O