CHEBI:184979 - ox-LGD2

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name ox-LGD2
ChEBI ID CHEBI:184979
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H30O6
Net Charge 0
Average Mass 366.454
Monoisotopic Mass 366.20424
InChI InChI=1S/C20H30O6/c1-3-4-7-10-15(21)13-14-17-16(19(24)26-20(17,2)25)11-8-5-6-9-12-18(22)23/h5,8,13-15,21,25H,3-4,6-7,9-12H2,1-2H3,(H,22,23)/b8-5-,14-13+/t15-,20?/m0/s1
InChIKey RAQOIYLDXSAKSS-DPLATEDBSA-N
SMILES O1C(O)(C(=C(C/C=C\CCCC(O)=O)C1=O)/C=C/[C@@H](O)CCCCC)C
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing ox-LGD2 (CHEBI:184979) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name
(Z)-7-[5-hydroxy-4-[(E,3S)-3-hydroxyoct-1-enyl]-5-methyl-2-oxouran-3-yl]hept-5-enoic acid
Manual Xrefs Databases
113369482 ChemSpider
LMFA03100037 LIPID MAPS
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