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CHEBI:74696 - 1-octadecanoyl-2-(9Z)-hexadecenoyl-sn-glycero-3-phosphate(2−)

ChEBI IDCHEBI:74696
ChEBI Name1-octadecanoyl-2-(9Z)-hexadecenoyl-sn-glycero-3-phosphate(2−)
Stars
ASCII Name1-octadecanoyl-2-(9Z)-hexadecenoyl-sn-glycero-3-phosphate(2-)
DefinitionA 1,2-diacyl-sn-glycerol 3-phosphate(2−) obtained by deprotonation of the phosphate OH groups of 1-octadecanoyl-2-(9Z)-hexadecenoyl-sn-glycero-3-phosphate.
Last Modified5 August 2013
SubmitterHnin
DownloadsMolfile
FormulaC37H69O8P
Net Charge-2
Average Mass672.925
Monoisotopic Mass672.47410
SMILES[H][C@@](COC(=O)CCCCCCCCCCCCCCCCC)(COP(=O)([O-])[O-])OC(=O)CCCCCCC/C=C\CCCCCC
InChIInChI=1S/C37H71O8P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-36(38)43-33-35(34-44-46(40,41)42)45-37(39)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h14,16,35H,3-13,15,17-34H2,1-2H3,(H2,40,41,42)/p-2/b16-14-/t35-/m1/s1
InChIKeyNLVQCMNLQFFKPE-WMHOIYFHSA-L
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
1-octadecanoyl-2-(9Z)-hexadecenoyl-sn-glycero-3-phosphate(2−) (CHEBI:74696) is a 1,2-diacyl-sn-glycerol 3-phosphate(2−) (CHEBI:58608)
1-octadecanoyl-2-(9Z)-hexadecenoyl-sn-glycero-3-phosphate(2−) (CHEBI:74696) is conjugate base of 1-octadecanoyl-2-(9Z)-hexadecenoyl-sn-glycero-3-phosphate (CHEBI:75073)
Incoming Relation(s)
1-octadecanoyl-2-(9Z)-hexadecenoyl-sn-glycero-3-phosphate (CHEBI:75073) is conjugate acid of 1-octadecanoyl-2-(9Z)-hexadecenoyl-sn-glycero-3-phosphate(2−) (CHEBI:74696)
IUPAC Name 
(2R)-2-[(9Z)-hexadec-9-enoyloxy]-3-(octadecanoyloxy)propyl phosphate
Synonyms  Source
PA(18:0/16:1(9Z))SUBMITTER
1-stearoyl-2-palmitoleoyl-sn-glycero-3-phosphate(2−)ChEBI