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CHEBI:71005 - (3S,4S)-3-hydroxy-4-methyldecanoic acid

ChEBI IDCHEBI:71005
ChEBI Name(3S,4S)-3-hydroxy-4-methyldecanoic acid
Stars
ASCII Name(3S,4S)-3-hydroxy-4-methyldecanoic acid
DefinitionA 3-hydroxy monocarboxylic acid that is 3-hydroxydecanoic acid substituted by a methyl group at position 4 (the 3S,4S stereoisomer).
Last Modified21 February 2013
Submitternamrata
DownloadsMolfile
FormulaC11H22O3
Net Charge0
Average Mass202.294
Monoisotopic Mass202.15689
SMILESCCCCCC[C@H](C)[C@@H](O)CC(=O)O
InChIInChI=1S/C11H22O3/c1-3-4-5-6-7-9(2)10(12)8-11(13)14/h9-10,12H,3-8H2,1-2H3,(H,13,14)/t9-,10-/m0/s1
InChIKeyMQCYTQLWRHLCHW-UWVGGRQHSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(3S,4S)-3-hydroxy-4-methyldecanoic acid (CHEBI:71005) has functional parent decanoic acid (CHEBI:30813)
(3S,4S)-3-hydroxy-4-methyldecanoic acid (CHEBI:71005) is a 3-hydroxy monocarboxylic acid (CHEBI:35969)
(3S,4S)-3-hydroxy-4-methyldecanoic acid (CHEBI:71005) is a branched-chain fatty acid (CHEBI:35819)
(3S,4S)-3-hydroxy-4-methyldecanoic acid (CHEBI:71005) is a hydroxy fatty acid (CHEBI:24654)
(3S,4S)-3-hydroxy-4-methyldecanoic acid (CHEBI:71005) is a medium-chain fatty acid (CHEBI:59554)
Incoming Relation(s)
arenamide A (CHEBI:65433) has functional parent (3S,4S)-3-hydroxy-4-methyldecanoic acid (CHEBI:71005)
IUPAC Name 
(3S,4S)-3-hydroxy-4-methyldecanoic acid
Synonym  Source
3-hydroxy-4-methyldecanoic acidChEBI