Basic information
- Name:
Methylglucamine antimonate
- CAS No.:
133-51-7
- Molecular Structure:
- Formula:
- C7H17NO5.HSbO3
- Molecular Weight:
- 365.98
- Synonyms:
- Glucitol, 1-deoxy-1-(methylamino)-, compd. with antimonic acid (1:1), D-;Glucantime;Protostib;1-Deoxy-1-(methylamino)-D-glucitol, compound with antimonic acid (1:1);hydroxy-dioxo-stiborane; (2R,3R,4R,5S)-6-methylaminohexane-1,2,3,4,5-pentol;D-Glucitol, 1-deoxy-1-(methylamino)-, trioxoantimonate(1-);D-Glucitol, 1-deoxy-1-(methylamino)-, compd. with antimonic acid (1:1);1-Deoxy-1-(methylamino)glucitol antimonate(V);D-Glucitol,1-deoxy-1-(methylamino)-,trioxoantimonate(1-);N-Methylglucamine antimonate;N-Methyl glucamine Antimoniate;Meglumine antimonate;
- EINECS:
- 205-108-3
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Specification
The Methylglucamine antimonate, with the CAS registry number 133-51-7, is also known as 1-Deoxy-1-(methylamino)-D-glucitol, compound with antimonic acid (1:1). Its EINECS registry number is 205-108-3. This chemical's molecular formula is C7H18NO8Sb and molecular weight is 365.97972. Its IUPAC name is called hydroxy(dioxo)-λ5-stibane;(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol. This chemical's classification codes are Anti-Infective Agents; Antiparasitic Agents; Antiprotozoal Agents; Drug / Therapeutic Agent; Human Data.
Physical properties of Methylglucamine antimonate: (1)H-Bond Donor: 7; (2)H-Bond Acceptor: 9; (3)Rotatable Bond Count: 6; (4)Exact Mass: 365.00706; (5)MonoIsotopic Mass: 365.00706; (6)Topological Polar Surface Area: 168; (7)Heavy Atom Count: 17; (8)Formal Charge: 0; (9)Complexity: 180; (10)Isotope Atom Count: 0; (11)Defined Atom StereoCenter Count: 4; (12)Undefined Atom StereoCenter Count: 0; (13)Defined Bond StereoCenter Count: 0; (14)Undefined Bond StereoCenter Count: 0; (15)Covalently-Bonded Unit Count: 2.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CNCC(C(C(C(CO)O)O)O)O.O[Sb](=O)=O
(2)Isomeric SMILES: CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O.O[Sb](=O)=O
(3)InChI: InChI=1S/C7H17NO5.H2O.2O.Sb/c1-8-2-4(10)6(12)7(13)5(11)3-9;;;;/h4-13H,2-3H2,1H3;1H2;;;/q;;;;+1/p-1/t4-,5+,6+,7+;;;;/m0..../s1
(4)InChIKey: XOGYVDXPYVPAAQ-SESJOKTNSA-M
The toxicity data is as follows:
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| child | TDLo | unreported | 700mg/kg/7D (700mg/kg) | KIDNEY, URETER, AND BLADDER: INTERSTITIAL NEPHRITIS KIDNEY, URETER, AND BLADDER: URINE VOLUME INCREASED KIDNEY, URETER, AND BLADDER: URINE VOLUME DECREASED | Maroc Medical. Vol. 41, Pg. 1180, 1962. |