ChemSpider 2D Image | (2S,8R,19Z)-2-Ammonio-8-hydroxy-5-oxido-11-oxo-4,6,10-trioxa-5-phosphaoctacos-19-en-1-oate 5-oxide | C24H45NO9P

(2S,8R,19Z)-2-Ammonio-8-hydroxy-5-oxido-11-oxo-4,6,10-trioxa-5-phosphaoctacos-19-en-1-oate 5-oxide

  • Molecular FormulaC24H45NO9P
  • Average mass522.590 Da
  • Monoisotopic mass522.283752 Da
  • ChemSpider ID29368371

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,8R,19Z) 5-Oxyde de 2-ammonio-8-hydroxy-11-oxo-5-oxydo-4,6,10-trioxa-5-phosphaoctacos-19-én-1-oate [French] [ACD/IUPAC Name]
(2S,8R,19Z)-2-Ammonio-8-hydroxy-5-oxido-11-oxo-4,6,10-trioxa-5-phosphaoctacos-19-en-1-oat-5-oxid [German] [ACD/IUPAC Name]
(2S,8R,19Z)-2-Ammonio-8-hydroxy-5-oxido-11-oxo-4,6,10-trioxa-5-phosphaoctacos-19-en-1-oate 5-oxide [ACD/IUPAC Name]
9-Octadecenoic acid, (2R)-3-[[[(2S)-2-amino-2-carboxyethoxy]hydroxyphosphinyl]oxy]-2-hydroxypropyl ester, inner salt, ion(1-), (9Z)- [ACD/Index Name]
(2S,8R,19Z)-2-azaniumylo-8-hydroxy-5-oxido-11-oxo-4,6,10-trioxa-5-phosphaoctacos-19-en-1-oate 5-oxide
1-(9Z)-octadecenoyl-sn-glycero-3-phosphoserine
1-(9Z)-octadecenoyl-sn-glycero-3-phosphoserine(1-)
1-(9Z-octadecenoyl)-sn-glycero-3-phospho-L-serine
1-C18:1(ω-9)-lysophosphatidylserine
1-oleoyl-sn-glycero-3-phosphoserine(1-)
  • Miscellaneous

    • Chemical Class:

      A 1-acyl-sn-glycero-3-phosphoserine(1-) that is the conjugate base of 1-oleoyl-sn-glycero-3-phosphoserine. ChEBI CHEBI:74617

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

Density:
Boiling Point: 673.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.7 mmHg at 25°C
Enthalpy of Vaporization: 113.1±6.0 kJ/mol
Flash Point: 360.9±34.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 25
#Rule of 5 Violations: 4
ACD/LogP: 6.51
ACD/LogD (pH 5.5): 1.61
ACD/BCF (pH 5.5): 1.41
ACD/KOC (pH 5.5): 4.51
ACD/LogD (pH 7.4): 1.50
ACD/BCF (pH 7.4): 1.12
ACD/KOC (pH 7.4): 3.56
Polar Surface Area: 183 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement