Found 1 result

Search term: C51H76NO9P (Found by molecular formula)
ChemSpider 2D Image | (15Z,18Z,21Z,24Z,27Z,30Z)-3-Amino-6-hydroxy-6-oxido-2,12-dioxo-5,7,11-trioxa-6lambda~5~-phosphatritriaconta-15,18,21,24,27,30-hexaen-9-yl (4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,16,19-docosahexaenoate | C51H76NO9P

(15Z,18Z,21Z,24Z,27Z,30Z)-3-Amino-6-hydroxy-6-oxido-2,12-dioxo-5,7,11-trioxa-6λ5-phosphatritriaconta-15,18,21,24,27,30-hexaen-9-yl (4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,16,19-docosahexaenoate

  • Molecular FormulaC51H76NO9P
  • Average mass878.124 Da
  • Monoisotopic mass877.525757 Da
  • ChemSpider ID24608378

  • Double-bond stereo - Double-bond stereo

More details:

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

(15Z,18Z,21Z,24Z,27Z,30Z)-3-Amino-6-hydroxy-6-oxido-2,12-dioxo-5,7,11-trioxa-6λ5-phosphatritriaconta-15,18,21,24,27,30-hexaen-9-yl (4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,16,19-docosahexaenoate [ACD/IUPAC Name]
(15Z,18Z,21Z,24Z,27Z,30Z)-3-Amino-6-hydroxy-6-oxido-2,12-dioxo-5,7,11-trioxa-6λ5-phosphatritriaconta-15,18,21,24,27,30-hexaen-9-yl-(4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,16,19-docosahexaenoat [German] [ACD/IUPAC Name]
(4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,16,19-Docosahexaénoate de (15Z,18Z,21Z,24Z,27Z,30Z)-3-amino-6-hydroxy-2,12-dioxo-6-oxydo-5,7,11-trioxa-6λ5-phosphatritriaconta-15,18,21,24,27,30-hexaén-9-yle [French] [ACD/IUPAC Name]
4,7,10,13,16,19-Docosahexaenoic acid, 1-[[[(2-amino-3-oxobutoxy)hydroxyphosphinyl]oxy]methyl]-1,2-ethanediyl ester, (4Z,7Z,10Z,13Z,16Z,19Z,4'Z,7'Z,10'Z,13'Z,16'Z,19'Z)- [ACD/Index Name]
Phosphatidylserine 22:6-22:6

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

Density: 1.0±0.1 g/cm3
Boiling Point: 857.4±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 135.2±6.0 kJ/mol
Flash Point: 472.4±37.1 °C
Index of Refraction: 1.529
Molar Refractivity: 257.9±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 40
#Rule of 5 Violations: 3
ACD/LogP: 13.38
ACD/LogD (pH 5.5): 6.28
ACD/BCF (pH 5.5): 6954.22
ACD/KOC (pH 5.5): 2929.11
ACD/LogD (pH 7.4): 5.70
ACD/BCF (pH 7.4): 1854.07
ACD/KOC (pH 7.4): 780.93
Polar Surface Area: 161 Å2
Polarizability: 102.3±0.5 10-24cm3
Surface Tension: 40.8±3.0 dyne/cm
Molar Volume: 836.6±3.0 cm3

Click to predict properties on the Chemicalize site


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