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CHEBI:140525 - sn-1,2-diricinolein

Default Structure
ChEBI IDCHEBI:140525
ChEBI Namesn-1,2-diricinolein
Stars
DefinitionA 1,2-diacyl-sn-glycerol in which the 1- and 2-acyl groups are specified as 12-hydroxy-(9Z)-octadecenoyl.
Last Modified11 February 2020
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC39H72O7
Net Charge0
Average Mass652.998
Monoisotopic Mass652.52780
SMILESCCCCCC[C@H](O)C/C=C\CCCCCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCC/C=C/C[C@@H](O)CCCCCC
InChIInChI=1S/C39H72O7/c1-3-5-7-21-27-35(41)29-23-17-13-9-11-15-19-25-31-38(43)45-34-37(33-40)46-39(44)32-26-20-16-12-10-14-18-24-30-36(42)28-22-8-6-4-2/h17-18,23-24,35-37,40-42H,3-16,19-22,25-34H2,1-2H3/b23-17+,24-18-/t35-,36-,37-/m0/s1
InChIKeyIZAGFRITZBFHFI-TUAYVKMKSA-N
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
ChEBI Ontology
Outgoing Relation(s)
sn-1,2-diricinolein (CHEBI:140525) is a 1,2-diacyl-sn-glycerol (CHEBI:17815)
UniProt Name  Source
1,2-di-(12R-hydroxy-9Z-octadecenoyl)-sn-glycerolUniProt
Citations