ChemSpider 2D Image | trans-(15S)-Latanoprost | C26H40O5

trans-(15S)-Latanoprost

  • Molecular FormulaC26H40O5
  • Average mass432.593 Da
  • Monoisotopic mass432.287567 Da
  • ChemSpider ID28467793

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 5 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(5E)-7-{(1R,2R,3R,5S)-3,5-Dihydroxy-2-[(3S)-3-hydroxy-5-phénylpentyl]cyclopentyl}-5-hepténoate d'isopropyle [French] [ACD/IUPAC Name]
1235141-39-5 [RN]
5-Heptenoic acid, 7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(3S)-3-hydroxy-5-phenylpentyl]cyclopentyl]-, 1-methylethyl ester, (5E)- [ACD/Index Name]
Isopropyl (5E)-7-{(1R,2R,3R,5S)-3,5-dihydroxy-2-[(3S)-3-hydroxy-5-phenylpentyl]cyclopentyl}-5-heptenoate [ACD/IUPAC Name]
Isopropyl-(5E)-7-{(1R,2R,3R,5S)-3,5-dihydroxy-2-[(3S)-3-hydroxy-5-phenylpentyl]cyclopentyl}-5-heptenoat [German] [ACD/IUPAC Name]
trans-(15S)-Latanoprost
(5E)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(3S)-3-hydroxy-5-phenylpentyl]cyclopentyl]-5-heptenoic acid 1-methyl ethyl ester
(5E,15S)-Latanoprost
(Z)-isopropyl 7-((1R,2R,3R,5S)-3,5-dihydroxy-2-((S)-3-hydroxy-5-phenylpentyl)cyclopentyl)hept-5-enoate
145773-22-4 [RN]
More...

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 583.8±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 91.8±3.0 kJ/mol
    Flash Point: 188.3±23.6 °C
    Index of Refraction: 1.538
    Molar Refractivity: 123.6±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 3
    #Freely Rotating Bonds: 14
    #Rule of 5 Violations: 0
    ACD/LogP: 3.65
    ACD/LogD (pH 5.5): 4.11
    ACD/BCF (pH 5.5): 787.09
    ACD/KOC (pH 5.5): 4116.97
    ACD/LogD (pH 7.4): 4.11
    ACD/BCF (pH 7.4): 787.09
    ACD/KOC (pH 7.4): 4116.97
    Polar Surface Area: 87 Å2
    Polarizability: 49.0±0.5 10-24cm3
    Surface Tension: 43.4±3.0 dyne/cm
    Molar Volume: 395.5±3.0 cm3

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