EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:179081 - PA(17:1(9Z)/17:0)

ChEBI IDCHEBI:179081
ChEBI NamePA(17:1(9Z)/17:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H71O8P
Net Charge0
Average Mass674.941
Monoisotopic Mass674.48866
SMILESCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)O)OC(=O)CCCCCCCCCCCCCCCC
InChIInChI=1S/C37H71O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-36(38)43-33-35(34-44-46(40,41)42)45-37(39)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h15,17,35H,3-14,16,18-34H2,1-2H3,(H2,40,41,42)/b17-15-/t35-/m1/s1
InChIKeyACZAAQYGKSBJDM-SFENZSGWSA-N
Roles Classification
Biological Role:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
PA(17:1(9Z)/17:0) (CHEBI:179081) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name 
[(2R)-1-[(Z)-heptadec-9-enoyl]oxy-3-phosphonooxypropan-2-yl] heptadecanoate
Manual XrefsDatabases
LMGP10010254LIPID MAPS