CHEBI:230332 - MG(18:1(12Z)-2OH(9,10)/0:0/0:0)

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ChEBI Name MG(18:1(12Z)-2OH(9,10)/0:0/0:0)
ChEBI ID CHEBI:230332
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H40O6
Net Charge 0
Average Mass 388.545
Monoisotopic Mass 388.28249
InChI InChI=1S/C21H40O6/c1-2-3-4-5-7-10-13-19(24)20(25)14-11-8-6-9-12-15-21(26)27-17-18(23)16-22/h7,10,18-20,22-25H,2-6,8-9,11-17H2,1H3/b10-7-/t18-,19+,20+/m0/s1
InChIKey RLKGCXCVPAYULW-QTZWXKQRSA-N
SMILES O[C@H](CCCCCCCC(OC[C@@H](O)CO)=O)[C@H](O)C/C=C\CCCCC
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). See: MetaboLights Study
ChEBI Ontology
Outgoing MG(18:1(12Z)-2OH(9,10)/0:0/0:0) (CHEBI:230332) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name
[(2S)-2,3-dihydroxypropyl] (Z,9R,10R)-9,10-dihydroxyoctadec-12-enoate
Manual Xrefs Databases
117217005 ChemSpider
HMDB0260490 HMDB
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