Phosphatidylcholine; Glycerol 2-(8,11,14-eicosatrienoate) 1-hexadecanoate 3-phosphocholine

AlkaPlorer ID: AK310276

Synonym: 1-O-Hexadecyl-2-O-dihomogammalinolenoylglycero-3-phosphocholine 

IUPAC Name: 2-[[3-hexadecoxy-2-[(8E,11E,14E)-icosa-8,11,14-trienoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium

Structure

SMILES: CCCCC/C=C/C/C=C/C/C=C/CCCCCCC(=O)OC(COCCCCCCCCCCCCCCCC)COP(=O)(O)OCC[N+](C)(C)C

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InChI: InChI=1S/C44H84NO7P/c1-6-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-44(46)52-43(42-51-53(47,48)50-40-38-45(3,4)5)41-49-39-36-34-32-30-28-26-21-19-17-15-13-11-9-7-2/h14,16,20,22,24-25,43H,6-13,15,17-19,21,23,26-42H2,1-5H3/p+1/b16-14+,22-20+,25-24+

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InChIKey: VYKSGWCIVDQIQR-FGLAEDNVSA-O

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Reference

PubChem CID: 5941565

CAS: 131907-73-8

Source

Species Genus Family Order Class Phylum Kingdom Domain
Crassostrea gigas Crassostrea Ostreidae Ostreida Bivalvia Mollusca Metazoa Eukaryota

Properties Information

Molecule Weight: 771.1380000000001

TPSA: 91.29

MolLogP: 12.60559999999998

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information