BMFYB4DAs011

Basic Metabolism Top (代謝トップ)

Molecule Index (化合物索引)

EC classes ( EC分類)

Input New Data (新規入力)

Upper classes : BM Basic Metabolites : BMFY Fatty acyl 脂肪酸 :  BMFYB branched chain 分岐 (200 pages)

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	126576-14-5
KEGG	C04411
KNApSAcK	{{{KNApSAcK}}}
CDX file
MOL file	BMFYB4DAs011.mol

3-Isopropylmalate
Structural Information
Systematic Name	(2R,3S) -2-Hydroxy-3-propan-2-ylbutanedioic acid
Common Name	3-Isopropylmalate (2R,3S) -3-Isopropylmalate 3-Carboxy-2-hydroxy-4-methylpentanoate 2-D-threo-Hydroxy-3-carboxy-isocaproate 3-Carboxy-2-hydroxy-4-methyl-pentanoic acid
Symbol
Formula	C7H12O5
Exact Mass	176.0684
Average Mass	176.1671
SMILES	CC(C)C(C(O)=O)C(O)C(O)=O
Physicochemical Information
Melting Point
Boiling Point
Density
Optical Rotation
Reflactive Index
Solubility
Spectral Information
Mass Spectra
UV Spectra
IR Spectra
NMR Spectra
Chromatograms

Related Atomic Mappings, Enzymes, and Pathways

• this ⇔ 4-Methyl-2-oxo-pentanoic acid
• this ⇔ (Z) -2-Propan-2-ylbut-2-enedioic acid
• this ⇔ 2-Oxo-3-propan-2-ylbutanedioic acid
• this ⇔ CO2

• EC1.1.1.85
• EC4.2.1.33

• Leucine_biosynthesis
• Leucine_biosynthesis