CHEBI:196659 - PC(12:0/14:1(9Z))

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name PC(12:0/14:1(9Z))
ChEBI ID CHEBI:196659
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C34H66NO8P
Net Charge 0
Average Mass 647.875
Monoisotopic Mass 647.45261
InChI InChI=1S/C34H66NO8P/c1-6-8-10-12-14-16-17-19-21-23-25-27-34(37)43-32(31-42-44(38,39)41-29-28-35(3,4)5)30-40-33(36)26-24-22-20-18-15-13-11-9-7-2/h12,14,32H,6-11,13,15-31H2,1-5H3/b14-12-/t32-/m1/s1
InChIKey AGJOABASFWYXRJ-AXLWDLOMSA-N
SMILES P(OCC[N+](C)(C)C)(OC[C@H](OC(=O)CCCCCCC/C=C\CCCC)COC(=O)CCCCCCCCCCC)([O-])=O
ChEBI Ontology
Outgoing PC(12:0/14:1(9Z)) (CHEBI:196659) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name
[(2R)-3-dodecanoyloxy-2-[(Z)-tetradec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual Xrefs Databases
113374885 ChemSpider
LMGP01011316 LIPID MAPS
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