CHEBI:178291 - PC(13:0/15:1(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(13:0/15:1(9Z))
ChEBI ID CHEBI:178291
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C36H70NO8P
Net Charge 0
Average Mass 675.929
Monoisotopic Mass 675.48391
InChI InChI=1S/C36H70NO8P/c1-6-8-10-12-14-16-18-19-21-23-25-27-29-36(39)45-34(33-44-46(40,41)43-31-30-37(3,4)5)32-42-35(38)28-26-24-22-20-17-15-13-11-9-7-2/h14,16,34H,6-13,15,17-33H2,1-5H3/b16-14-/t34-/m1/s1
InChIKey MXDRPELNTFTIPG-CVBYVTFXSA-N
SMILES P(OCC[N+](C)(C)C)(OC[C@H](OC(=O)CCCCCCC/C=C\CCCCC)COC(=O)CCCCCCCCCCCC)([O-])=O
ChEBI Ontology
Outgoing PC(13:0/15:1(9Z)) (CHEBI:178291) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name
[(2R)-2-[(Z)-pentadec-9-enoyl]oxy-3-tridecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual Xref Database
LMGP01011341 LIPID MAPS
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