3-Hydroxy-3-methylglutaric acid - CAS 503-49-1
Catalog: |
BB027023 |
Product Name: |
3-Hydroxy-3-methylglutaric acid |
CAS: |
503-49-1 |
Synonyms: |
3-hydroxy-3-methylpentanedioic acid |
Application: |
A hypolipidemic agent |
IUPAC Name: | 3-hydroxy-3-methylpentanedioic acid |
Description: | Meglutol is a hypolipidemic agent which inhibits the activity of hydroxymethylglutarryl CoA reductases. |
Molecular Weight: | 162.14 |
Molecular Formula: | C6H10O5 |
Canonical SMILES: | CC(CC(=O)O)(CC(=O)O)O |
InChI: | InChI=1S/C6H10O5/c1-6(11,2-4(7)8)3-5(9)10/h11H,2-3H2,1H3,(H,7,8)(H,9,10) |
InChI Key: | NPOAOTPXWNWTSH-UHFFFAOYSA-N |
Boiling Point: | 354.3 ℃ at 760 mmHg |
Melting Point: | 106-110 ℃ |
Purity: | ≥ 95 % |
Density: | 1.417 g/cm3 |
Solubility: | Soluble in DMSO |
Appearance: | White to off-white solid |
Storage: | Store at -20 ℃ |
MDL: | MFCD00002712 |
LogP: | -0.31320 |
Quality Standard: | Enterprise Standard/USP |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22721781 | 20120901 | Flavonol glycosides acylated with 3-hydroxy-3-methylglutaric acid as systematic characters in Rosa | Phytochemistry |
22572385 | 20120401 | Gymnopilin--a substance produced by the hallucinogenic mushroom, Gymnopilus junonius--mobilizes intracellular Ca(2+) in dorsal root ganglion cells | Biomedical research (Tokyo, Japan) |
22036895 | 20120201 | HMGA-targeted phosphorothioate DNA aptamers increase sensitivity to gemcitabine chemotherapy in human pancreatic cancer cell lines | Cancer letters |
22448338 | 20120101 | Effects of high-mobility group a protein application on canine adipose-derived mesenchymal stem cells in vitro | Veterinary medicine international |
22590580 | 20120101 | Pharmacogenetics meets metabolomics: discovery of tryptophan as a new endogenous OCT2 substrate related to metformin disposition | PloS one |
Complexity: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 162.05282342 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 162.05282342 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 94.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1.2 |
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