Metacyclinhydrochlorid
Methacycline Hydrochloride
Grundinformationen
- CAS
3963-95-9- Standard-SMILES
C=C1c2cccc(O)c2C(O)=C2C(=O)[C@]3(O)C(O)=C(C(N)=O)C(=O)[C@@H](N(C)C)[C@@H]3[C@@H](O)[C@H]12.Cl- InChIKey
VZQARNDJLLWXGL-ATGQEJIKNA-N- Summenformel
- C22H23ClN2O8
- Durchschnittliche Molmasse
- 478,9 g/mol
- Monoisotopische Masse
- 478,1142934
Überblick
Methacycline Hydrochloride can cause developmental toxicity according to state or federal government labeling requirements.
Namen und Bezeichner
- Bevorzugter Name
- Methacycline Hydrochloride
- IUPAC
- (4S,4aR,5S,5aR,12aR)-4-(dimethylamino)-1,5,10,11,12a-pentahydroxy-6-methylidene-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide;hydrochloride
- Lokaler Name
- Metacyclinhydrochlorid
- Englischer Name
- Metacycline hydrochloride
- Summenformel
- C22H23ClN2O8
- Molmasse
- 478.88
Namen und Synonyme
METHACYCLINE HYDROCHLORIDE3963-95-9Methacycline HClAdriamicinaCiclobioticGermiciclinGlobociclinaMegamycineMetilenbioticMetadomusOptimycinRindex
Weitere Namen anzeigen
METACYCLINEMETACYCLINE HCLMethacycL
LondomycinNSC-356465DTXSID5045382UNII-9GJ0N7ZAP0EINECS 223-568-39GJ0N7ZAP0NSC356465NSC 356465
Datenbank-Bezeichner
- CAS
3963-95-9- PubChem CID
- 54685047
- DTXSID
DTXSID5045382- ChEMBL
CHEMBL2146123- ChEBI
CHEBI:6806- UNII
- 9GJ0N7ZAP0
- EC Number
- 223-568-3
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 182 Ų
- H-Brücken-Donoren
- 7
- H-Brücken-Akzeptoren
- 9
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 33
- Formalladung
- 0
- Komplexität
- 998
Experimentelle und physikochemische Eigenschaften
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
Collision Cross Section194.9 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
Physikochemische Eigenschaften
- Schmelzpunkt
- 224 °C · >224°C(dec.)
- storage temp.
- Inert atmosphere,Room Temperature
- Löslichkeit
- DMSO (Slightly, Heated), Methanol (Slightly, Heated, Sonicated), Water (Slightly)
- Aggregatzustand
- Crystalline Powder
- Farbe
- Yellow
- BRN
- 5470951 · 5470951
- Major Application
- pharmaceutical (small molecule)
- InChIKey
- VZQARNDJLLWXGL-ATGQEJIKNA-N
- SMILES
- O[C@@]12C(C(C(=O)N)=C(O)[C@@H](N(C)C)[C@]1([H])[C@H]([C@]1([H])C(C3C=CC=C(O)C=3C(=O)C1=C2O)=C)O)=O.Cl |&1:1,9,13,15,16,r|
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Hazard Traits - Developmental Toxicity
2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methylene-1,11-dioxo-, monohydrochloride, (4S,4aR,5S,5aR,12aS)-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Other Safety Information
IMAP assessments - 2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methylene-1,11-dioxo-, monohydrochloride, [4S-(4.alpha.,4a.alpha.,5.alpha.,5a.alpha.,12a.alpha.)]-: Environment tier I assessment
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- wgk
- 2
- hs_code
- 29413020
- RTECS-Nr.
- QI9276000
- Toxizität
- LD50 in rats, mice (mg/kg): 252, 288 i.p. (Goldenthal)
Chemie und Industrie
Anwendungen
BeschreibungMethacycline is a tetracycline-class antibiotic that is active against a wide range of Gram-positive and Gram-negative organisms. It is readily absorbed from the gastrointestinal tract and reaches a maximum concentration at about the fourth hour, declining to a negligible amount in about 24 hours. It is more active than tetracycline against a number of bacteria.
VerwendenBroad spectrum, semisynthetic antibiotic related to Tetracycline. Antibacterial.
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