CHEBI:187720 - PI(O-20:0/0:0)

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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(O-20:0/0:0)
ChEBI ID CHEBI:187720
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C29H59O11P
Net Charge 0
Average Mass 614.754
Monoisotopic Mass 614.37950
InChI InChI=1S/C29H59O11P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-38-21-23(30)22-39-41(36,37)40-29-27(34)25(32)24(31)26(33)28(29)35/h23-35H,2-22H2,1H3,(H,36,37)/t23-,24?,25-,26?,27?,28?,29?/m1/s1
InChIKey FHYCYULARSUKFT-DHASMXTASA-N
SMILES P(OC1C(O)C(O)C(O)[C@@H](O)C1O)(OC[C@H](O)COCCCCCCCCCCCCCCCCCCCC)(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(O-20:0/0:0) (CHEBI:187720) is a glycerophosphoinositol (CHEBI:36315)
IUPAC Name
[(2R)-2-hydroxy-3-icosoxypropyl] [(5R)-2,3,4,5,6-pentahydroxycyclohexyl] hydrogen phosphate
Manual Xref Database
LMGP06060001 LIPID MAPS
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