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CHEBI:182747 - (2S,3S)-3-Decyl-2-hydroxy-2-(3-methoxy-3-oxopropyl)butanedioic acid

Default Structure
ChEBI IDCHEBI:182747
ChEBI Name(2S,3S)-3-Decyl-2-hydroxy-2-(3-methoxy-3-oxopropyl)butanedioic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H32O7
Net Charge0
Average Mass360.447
Monoisotopic Mass360.21480
SMILESCCCCCCCCCC[C@H](C(=O)O)[C@@](O)(CCC(=O)OC)C(=O)O
InChIInChI=1S/C18H32O7/c1-3-4-5-6-7-8-9-10-11-14(16(20)21)18(24,17(22)23)13-12-15(19)25-2/h14,24H,3-13H2,1-2H3,(H,20,21)(H,22,23)/t14-,18+/m1/s1
InChIKeyGTLYLWQDKQVONL-KDOFPFPSSA-N
ChEBI Ontology
Outgoing Relation(s)
(2S,3S)-3-Decyl-2-hydroxy-2-(3-methoxy-3-oxopropyl)butanedioic acid (CHEBI:182747) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
(2S,3S)-3-decyl-2-hydroxy-2-(3-methoxy-3-oxopropyl)butanedioic acid
Manual XrefsDatabases
22842410ChemSpider