CHEBI:179040 - PC(19:1(9Z)/15:1(9Z))

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ChEBI Name PC(19:1(9Z)/15:1(9Z))
ChEBI ID CHEBI:179040
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C42H80NO8P
Net Charge 0
Average Mass 758.075
Monoisotopic Mass 757.56216
InChI InChI=1S/C42H80NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-25-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43(3,4)5)51-42(45)35-33-31-29-27-24-19-17-15-13-11-9-7-2/h15,17,21-22,40H,6-14,16,18-20,23-39H2,1-5H3/b17-15-,22-21-/t40-/m1/s1
InChIKey PORJVBHZWRAVRO-WVRXYBSSSA-N
SMILES P(OCC[N+](C)(C)C)(OC[C@H](OC(=O)CCCCCCC/C=C\CCCCC)COC(=O)CCCCCCC/C=C\CCCCCCCCC)([O-])=O
ChEBI Ontology
Outgoing PC(19:1(9Z)/15:1(9Z)) (CHEBI:179040) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name
[(2R)-3-[(Z)-nonadec-9-enoyl]oxy-2-[(Z)-pentadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual Xref Database
LMGP01011761 LIPID MAPS
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