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Spectinomycindihydrochlorid
SPECTINOMYCIN HYDROCHLORIDE · Gentamicin hydrochloride · M 141 · stanilo · U-18409AE · NSC 248616 · Spectacomycin · SPECTINOMYCIN 2HCL
Identifikatoren & physikalische Daten
| CAS No. | 21736-83-4 |
|---|---|
| Summenformel | C14H26Cl2N2O7 |
| Durchschnittliche Molmasse | 405,3 g/mol |
| Monoisotopische Masse | 404,11170653 g/mol |
| SMILES | CN[C@@H]1[C@H](O)[C@H](NC)[C@H]2O[C@@]3(O)C(=O)C[C@@H](C)O[C@H]3O[C@@H]2[C@H]1O.Cl.Cl |
| InChIKey | FOGDPGQSHLLYIK-XYQGXRRISA-N |
| PubChem CID | 64740 |
| ChEMBL | CHEMBL3184600 |
| ChEBI | CHEBI:9216 |
| EC No. | 244-554-3 |
| DTXSID | DTXSID9045429 |
| Lokaler Name | Spectinomycindihydrochlorid |
Chemische & physikalische Eigenschaften
| Polarare Oberfläche (TPSA) | 130 |
|---|---|
| H-Brücken-Donoren | 7 |
| H-Brücken-Akzeptoren | 9 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 25 |
| Formalladung | 0 |
| Komplexität | 478 |
| Collision Cross Section | 174.3 Ų [M+H]+ [CCS Type: TWMethod: calibrated with polyalanine and drug standards] |
| Schmelzpunkt | 194°C |
| Lagerbedingungen | Inert atmosphere,2-8°C |
| Löslichkeit | H2O: 50 mg/mL, clear, faintly yellow |
| Aggregatzustand | powder |
| Farbe | White to Off-White |
| InChIKey | BIPVCOUVVAMJMZ-CEDDKZKHNA-N |
| SMILES | N([C@H]1[C@H]([C@@H](NC)[C@H](O)[C@@]2([H])O[C@]3([H])O[C@H](C)CC(=O)[C@]3(O)O[C@]12[H])O)C.Cl |&1:1,2,3,6,8,11,14,19,22,r| |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 1.7% (1 of 59) of reports.DangerH317 (94.9%): May cause an allergic skin reaction [Warning Sensitization, Skin]P233, P260, P261, P271, P272, P280, P284, P302+P352, P304+P340, P321, P333+P317, P342+P316, P362+P364, P403, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 59 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Weitere Sicherheitsinformationen | IMAP assessments - 4H-Pyrano[2,3-b][1,4]benzodioxin-4-one, decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-, dihydrochloride, [2R-(2.alpha.,4a.beta.,5a.beta.,6.beta.,7.beta.,8.beta.,9.alpha.,9a.alpha.,10a.beta.)]-: Environment tier I assessment |
| Hazard Classes and Categories | Skin Sens. 1 (94.9%) |
| F | 10 |
| Wassergefährdungsklasse (WGK) | 2 |
| RTECS-Nr. | WG7400000 |
| Toxizität | monkey,LD50,oral,500mg/kg (500mg/kg),Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 7, Pg. 100, 1965. |
| Lagerklasse | 10 - Combustible liquids |
Anwendungen & Verwendung
Verwenden
SPECTINOMYCIN DIHYDROCHLORIDE is an antibiotic used in the treatment and control of infectious bacterial enteritis in animals. Used in drug testing against nonreplicating mycobacterium tuberculosis.