threo-alpha-methyl isocitrate
1,2,3-butanetricarboxylic acid, 3-hydroxy-
Identification
| Name | threo-alpha-methyl isocitrate |
| IUPAC | 3-hydroxybutane-1,2,3-tricarboxylic acid |
| CAS Number | 6061-95-6 |
| FDA UNII | 8518EC1Z2E |
| Molecular Formula | C7 H10 O7 |
| Molecular Weight | 206.15110000 |
Regulatory
Physical Properties
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Boiling Point | 330.98 °C. @ 760.00 mm Hg (est) |
| Flash Point | 335.00 °F. TCC ( 168.20 °C. ) (est) |
| logP (o/w) | -0.993 (est) |
| Soluble in | water, 1e+006 mg/L @ 25 °C (est) |
No sensory data available
Safety Information
| Oral/Parenteral Toxicity | Not determined |
| Dermal Toxicity | Not determined |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | information only not used for fragrances or flavors |
| Recommendation for threo-alpha-methyl isocitrate usage levels up to | not for fragrance use. |
| Recommendation for threo-alpha-methyl isocitrate flavor usage levels up to | not for flavor use. |
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Potential Uses
Natural Occurrence
Synonyms
1,2,3-
butanetricarboxylic acid, 3-hydroxy-
3-
carboxy-2,3-dideoxy-4-C-methylpentaric acid
3-
hydroxy-1,2,3-butane tricarboxylate
3-
hydroxy-1,2,3-butanetricarboxylate
3-
hydroxybutane-1,2,3-tricarboxylic acid
alpha-
methylisocitrate
DL-threo-alpha-
methylisocitrate
threo-alpha-
methylisocitrate
PubMed:
In vitro conversion of propionate to pyruvate by Salmonella enterica enzymes: 2-methylcitrate dehydratase (PrpD) and aconitase Enzymes catalyze the conversion of 2-methylcitrate to 2-methylisocitrate.
PubMed:
Salmonella typhimurium LT2 catabolizes propionate via the 2-methylcitric acid cycle.
PubMed:
Steric and conformational features of the aconitase mechanism.
PubMed:
pH profiles and isotope effects for aconitases from Saccharomycopsis lipolytica, beef heart, and beef liver. alpha-Methyl-cis-aconitate and threo-Ds-alpha-methylisocitrate as substrates.
PubMed:
NADP-specific isocitrate dehydrogenase in regulation of urea synthesis in rat hepatocytes.
PubMed:
Activities of NAD-specific and NADP-specific isocitrate dehydrogenases in rat-liver mitochondria. Studies with D-threo-alpha-methylisocitrate.
PubMed:
Identification of D-threo-alpha-methylisocitrate as stereochemically specific substrate for bovine heart aconitase and inhibitor of TPN-linked isocitrate dehydrogenase.
PubMed:
Alpha-methylisocitrate. A selective inhibitor of TPN-linked isocitrate dehydrogenase from bovine heart and rat liver.