CHEBI:185369 - PI(15:1(9Z)/19:0)

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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 PI(15:1(9Z)/19:0)
ChEBI ID CHEBI:185369
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C43H81O13P
Net Charge 0
Average Mass 837.082
Monoisotopic Mass 836.54148
InChI InChI=1S/C43H81O13P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-37(45)55-35(33-53-36(44)31-29-27-25-23-21-16-14-12-10-8-6-4-2)34-54-57(51,52)56-43-41(49)39(47)38(46)40(48)42(43)50/h12,14,35,38-43,46-50H,3-11,13,15-34H2,1-2H3,(H,51,52)/b14-12-/t35-,38?,39-,40?,41?,42?,43?/m1/s1
InChIKey LMUIULYUEZGDTB-LTGDPXNMSA-N
SMILES P(OC1C(O)C(O)C(O)[C@@H](O)C1O)(OC[C@H](OC(=O)CCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCC/C=C\CCCCC)(O)=O
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
ChEBI Ontology
Outgoing PI(15:1(9Z)/19:0) (CHEBI:185369) is a phosphatidylinositol (CHEBI:28874)
IUPAC Name
[(2R)-1-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxy-3-[(Z)-pentadec-9-enoyl]oxypropan-2-yl] nonadecanoate
Manual Xref Database
LMGP06010146 LIPID MAPS
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