(S)-2-methylbutanal (CHEBI:88414)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	(S)-2-methylbutanal

ChEBI ID	CHEBI:88414

ChEBI ASCII Name	(S)-2-methylbutanal

Definition	A 2-methylbutanal that has S configuration.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C5H10O

Net Charge

Average Mass

86.132

Monoisotopic Mass

86.07316

InChI

InChI=1S/C5H10O/c1-3-5(2)4-6/h4-5H,3H2,1-2H3/t5-/m0/s1

InChIKey

BYGQBDHUGHBGMD-YFKPBYRVSA-N

SMILES

CC[C@H](C)C(=O)[H]

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in faeces (UBERON:0001988). See: PubMed

Roles Classification
Biological Role(s):	Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). (via 2-methylbutanal ) volatile oil component Any plant metabolite that is found naturally as a component of a volatile oil. (via 2-methylbutanal ) plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. (via 2-methylbutanal )

ChEBI Ontology
Outgoing	(S)-2-methylbutanal (CHEBI:88414) is a 2-methylbutanal (CHEBI:16182)

Incoming	(1E,2S)-2-methylbutanal oxime (CHEBI:134628) has functional parent (S)-2-methylbutanal (CHEBI:88414) (1Z,2S)-2-methylbutanal oxime (CHEBI:134629) has functional parent (S)-2-methylbutanal (CHEBI:88414)

IUPAC Name

(2S)-2-methylbutanal

Last Modified

01 March 2017