CHEBI:183394 - Sorbitan monostearate

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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 Sorbitan monostearate
ChEBI ID CHEBI:183394
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C24H46O6
Net Charge 0
Average Mass 430.626
Monoisotopic Mass 430.32944
InChI InChI=1S/C24H46O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(27)29-19-21(26)24-23(28)20(25)18-30-24/h20-21,23-26,28H,2-19H2,1H3/t20-,21+,23+,24+/m0/s1
InChIKey HVUMOYIDDBPOLL-XWVZOOPGSA-N
SMILES O1[C@@]([C@H](O)[C@@H](O)C1)([C@H](O)COC(=O)CCCCCCCCCCCCCCCCC)[H]
Metabolite of Species Details
Bombus terrestris (NCBI:txid30195) Found in hemolymph (BTO:0000572). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195) Found in hindgut (BTO:0000510). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195) Found in brain (BTO:0000142). See: MetaboLights Study
ChEBI Ontology
Outgoing Sorbitan monostearate (CHEBI:183394) is a fatty acid ester (CHEBI:35748)
IUPAC Name
[(2R)-2-[(2R,3R,4S)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl] octadecanoate
Manual Xref Database
16736467 ChemSpider
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Registry Number Type Source
1338-41-6 CAS Registry Number ChemIDplus