PC(o-18:1(9Z)/18:2(9Z,12Z))

Base Information

• Chemical Name: PC(o-18:1(9Z)/18:2(9Z,12Z))
• CAS No.: 88542-97-6
• Molecular Formula: C44H84NO7P
• Molecular Weight: 770.114
• Wikidata: Q27162065
• Metabolomics Workbench ID: 14910
• Mol file: 88542-97-6.mol

Synonyms:PC(o-18:1(9Z)/18:2(9Z,12Z));88542-97-6;[(2R)-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-3-[(Z)-octadec-9-enoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate;1-(9Z-octadecenyl)-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphocholine;3,5,9-Trioxa-4-phosphaheptacos-18-en-1-aminium, 4-hydroxy-N,N,N-trimethyl-7-((1-oxo-9,12-octadecadienyl)oxy)-, inner salt, 4-oxide, (R-(Z,Z,Z))-;CHEBI:89881;LMGP01020264;1-Oleyl-2-linoleoyl-sn-glycero-3-phosphocholine;Q27162065

Chemical Property of PC(o-18:1(9Z)/18:2(9Z,12Z))

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 103.93000
• Density: g/cm³
• LogP: 13.04380
• XLogP3: 13.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 41
• Exact Mass: 769.59854102
• Heavy Atom Count: 53
• Complexity: 938

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC=CCCCCCCCCOCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCC=CCCCCC
• Isomeric SMILES: CCCCCCCC/C=C\CCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC