Chem
J-GLOBAL ID：200907075199643703
Nikkaji number：J2.605K
Isovaleric acid
イソ吉草酸
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C5H10O2
Molecular formula furigana： C5-H10-O2
Molecular weight： 102.133
InChI：
InChI=1S/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7)
InChI key：
GWYFCOCPABKNJV-UHFFFAOYSA-N
SMILES：
CC(C)CC(=O)O
Systematic name (6)：
- 3-メチル酪酸
- 3-メチルブタン酸
- β-メチル酪酸
- イソ吉草酸
- 3-メチルブタン酸エステル
Show all
- Isovaleric acid
- β-Methylbutyric acid
- Isopropylacetic acid
- 3-Methylbutanoic acid
- 3-Methylbutyric acid
Show all
Regulation number (4)：
- NY1400000
- EINECS2079753
- (2)-608
- TSCA(503-74-2)
KEGG COMPOUND：
C08262
Application (1)：
metabolite
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