Latanoprost acid
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Latanoprost acid
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CAS No:
41639-83-2
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Formula:
C23H34O5
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Chemical Name:
Latanoprost acid
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Synonyms:
5-Heptenoic acid,7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(3R)-3-hydroxy-5-phenylpentyl]cyclopentyl]-,(5Z)-;5-Heptenoic acid,7-[3,5-dihydroxy-2-(3-hydroxy-5-phenylpentyl)cyclopentyl]-,[1R-[1α(Z),2β(R*),3α,5α]]-;(5Z)-7-[(1R,2R,3R,5S)-3,5-Dihydroxy-2-[(3R)-3-hydroxy-5-phenylpentyl]cyclopentyl]-5-heptenoic acid;13,14-Dihydro-17-phenyl-18,19,20-trinor-PGF2α;PhXA 85;Latanoprost acid;(Z)-7-[(1R,2R,3R,5S)-3,5-Dihydroxy-2-((R)-3-hydroxy-5-phenylpentyl)cyclopentyl]hept-5-enoic acid
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CAS No:
Description
Latanoprost free acid is a prostaglandin Falpha that is an analogue of prostaglandin F2alpha in which the pentyl group has been replaced by 2-phenylethyl and where the the 13,14-double bond has undergone formal hydrogenation. Its isopropyl ester prodrug, latanoprost, is used in the treatment of open-angle glaucoma and ocular hypertension. It has a role as an antiglaucoma drug, an antihypertensive agent and an EC 4.2.1.1 (carbonic anhydrase) inhibitor. It is a prostaglandins Falpha and a hydroxy monocarboxylic acid.
Characteristics
97.99000
3.31940
Pale yellow oil
1.159 g/cm3
609.1ºC at 760 mmHg
336.2ºC
1.564
-20ºC
Safety Information
|Danger|H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]|P201, P202, P264, P270, P281, P301+P310, P308+P313, P321, P330, P405, and P501|Aggregated GHS information provided by 3 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:390.5
XLogP3:3.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:12
Exact Mass:390.24062418
Monoisotopic Mass:390.24062418
Topological Polar Surface Area:98
Heavy Atom Count:28
Complexity:472
Defined Atom Stereocenter Count:5
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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