PA(21:0/13:0) (CHEBI:196768)

CHEBI:196768 - PA(21:0/13:0)

Formula	C37H73O8P
Net Charge	0
Average Mass	676.957
Monoisotopic Mass	676.50431
SMILES	CCCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)O)OC(=O)CCCCCCCCCCCC
InChI	InChI=1S/C37H73O8P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-24-25-27-29-31-36(38)43-33-35(34-44-46(40,41)42)45-37(39)32-30-28-26-23-14-12-10-8-6-4-2/h35H,3-34H2,1-2H3,(H2,40,41,42)/t35-/m1/s1
InChIKey	QXILPSOYYISSKP-PGUFJCEWSA-N

Roles Classification

Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.

ChEBI Ontology

Outgoing Relation(s)
	PA(21:0/13:0) (CHEBI:196768) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)

IUPAC Name
[(2R)-3-phosphonooxy-2-tridecanoyloxypropyl] henicosanoate