CHEBI:184780 - (2R)-2-Hydroxy-3-[(9Z,12Z)-nonadeca-9,12-dienoyloxy]propyl (11Z)-icos-11-enoate

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ChEBI Name (2R)-2-Hydroxy-3-[(9Z,12Z)-nonadeca-9,12-dienoyloxy]propyl (11Z)-icos-11-enoate
ChEBI ID CHEBI:184780
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C42H76O5
Net Charge 0
Average Mass 661.065
Monoisotopic Mass 660.56928
InChI InChI=1S/C42H76O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-42(45)47-39-40(43)38-46-41(44)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h14,16-17,19-20,22,40,43H,3-13,15,18,21,23-39H2,1-2H3/b16-14-,19-17-,22-20-/t40-/m0/s1
InChIKey RAJBNTUUADCLND-IUEAALGGSA-N
SMILES O(C(=O)CCCCCCCCC/C=C\CCCCCCCC)C[C@@H](O)COC(=O)CCCCCCC/C=C\C/C=C\CCCCCC
Metabolite of Species Details
Bos taurus (NCBI:txid9913) Found in spermatozoon (BTO:0001277). of strain Holstein [LBO:0000132] See: MetaboLights Study
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
(via diglyceride )
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
(via diglyceride )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (2R)-2-Hydroxy-3-[(9Z,12Z)-nonadeca-9,12-dienoyloxy]propyl (11Z)-icos-11-enoate (CHEBI:184780) is a 1,3-diglyceride (CHEBI:47777)
IUPAC Name
[(2R)-2-hydroxy-3-[(9Z,12Z)-nonadeca-9,12-dienoyl]oxypropyl] (Z)-icos-11-enoate
Manual Xrefs Databases
74854571 ChemSpider
HMDB0056220 HMDB
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