Travoprost

CAS Registry Number®

157283-68-6
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CAS Name

Travoprost

Molecular Formula

C26H35F3O6

Molecular Mass

500.55

Cite this Page

Travoprost.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=157283-68-6 (retrieved 2024-05-25) (CAS RN: 157283-68-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

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-/m1/s1

InChIKey

InChIKey=MKPLKVHSHYCHOC-AHTXBMBWSA-N

SMILES

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

Canonical SMILES

O=C(OC(C)C)CCCC=CCC1C(O)CC(O)C1C=CC(O)COC2=CC=CC(=C2)C(F)(F)F

Other Names for this Substance

  • 5-Heptenoic acid, 7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3R)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]-1-buten-1-yl]cyclopentyl]-, 1-methylethyl ester, (5Z)-
  • 5-Heptenoic acid, 7-[3,5-dihydroxy-2-[3-hydroxy-4-[3-(trifluoromethyl)phenoxy]-1-butenyl]cyclopentyl]-, 1-methylethyl ester, [1R-[1α(Z),2β(1E,3R*),3α,5α]]-
  • 5-Heptenoic acid, 7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3R)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]-1-butenyl]cyclopentyl]-, 1-methylethyl ester, (5Z)-
  • AL 6221
  • Travoprost

Deleted or Replaced CAS Registry Numbers

207742-69-6

CAS INSIGHTSTM
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