Grundinformationen
- Standard-SMILES
CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccc(O)cc3)C(=O)N2[C@H]1C(=O)O.O.O.O- InChIKey
MQXQVCLAUDMCEF-CWLIKTDRSA-N- Summenformel
- C16H25N3O8S
- Durchschnittliche Molmasse
- 419,5 g/mol
- Monoisotopische Masse
- 419,13623576
Überblick
Amoxicillin trihydrate is a hydrate that is the trihydrate form of amoxicillin; a semisynthetic antibiotic, used either alone or in combination with potassium clavulanate (under the trade name Augmentin) for treatment of a variety of bacterial infections. It has a role as an antimicrobial agent and an antibacterial drug. It contains an amoxicillin.
Namen und Bezeichner
- Bevorzugter Name
- Amoxicillin Trihydrate
- IUPAC
- (2S,5R,6R)-6-[[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid;trihydrate
- Englischer Name
- Amoxicillin trihydrate
- Summenformel
- C16H21N3O6S
- Molmasse
- 383.42
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
61336-70-7- PubChem CID
- 62883
- DTXSID
DTXSID2022599- ChEBI
CHEBI:51254- UNII
- 804826J2HU
- EC Number
- 612-127-4、688-488-7、933-899-1
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 161 Ų
- H-Brücken-Donoren
- 7
- H-Brücken-Akzeptoren
- 10
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 28
- Formalladung
- 0
- Komplexität
- 590
Experimentelle und physikochemische Eigenschaften
Animal Drugs
Active Ingredients (Amoxicillin Trihydrate) -> FDA Greenbook
Pharmaceuticals -> UK Veterinary Medicines Directorate List
Physikochemische Eigenschaften
- Schmelzpunkt
- 200 °C · >200°C (dec.)
- Brechungsindex
- 302 ° · 302 ° (C=0.1, H2O)
- storage temp.
- 2 · Inert atmosphere,2-8°C
- Löslichkeit
- Slightly soluble in water, very slightly soluble in ethanol (96 per cent), practically insoluble in fatty oils. It dissolves in dilute acids and dilute solutions of alkali hydroxides.
- Aggregatzustand
- Solid
- Farbe
- White to Off-White
- Wasserlöslichkeit
- 3.4 mg/ml · Soluble in water at 3.4mg/ml.
- Merck
- 14 · 14,577
- JECFA Number
- 85 · 85
- BRN
- 7507120 · 7507120
- Major Application
- clinical testing
- InChIKey
- AIPFZZHNBUVELL-KQLYYQCPNA-N
- SMILES
- C([C@H]1C(S[C@]2([H])[C@H](NC(=O)[C@@H](C3C=CC(O)=CC=3)N)C(=O)N12)(C)C)(=O)O.O |&1:1,4,6,10,r|
- CAS Datenbank
- 61336 · 61336-70-7(CAS DataBase Reference)
- EPA chemische Informationen
- Amoxicillin trihydrate (61336-70-7)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H317 (78%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P233, P260, P261, P271, P272, P273, P280, P284, P302+P352, P304+P340, P321, P333+P317, P342+P316, P362+P364, P391, P403, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 182 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
H317 (50%): May cause an allergic skin reaction [Warning Sensitization, Skin]
Gefahrenhinweise
Hazard Classes and Categories
Skin Sens. 1 (78%)
Skin Sens. 1 (50%)
Sicherheitsdaten
- wgk
- 2
- hs_code
- 29411000
- RTECS-Nr.
- XH8300000
- risk_code
- 42/43
- Toxizität
- LD50 ipr-rat: 2870 mg/kg KSRNAM 7,3040,73
- hazard_code
- Xn,Xi
- safety_code
- 36-36/37-22
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Resp. Sens. 1Skin Sens. 1
Chemie und Industrie
Pharmakologische Informationen
Verwendung und Herstellung
Use Classification
Animal Drugs -> FDA Approved Animal Drug Products (Green Book) -> Active Ingredients
Veterinary Drug -> -> JECFA Functional Classes
Anwendungen
BeschreibungAmoxicillin was synthesized by Beecham Research Laboratories in 1968. A hydroxyl group was introduced on the benzene ring of ampicillin. Amoxicillin shows about a twofold higher serum concentration than ampicillin when administered orally. It was shown by double-blind comparative studies with ampicillin that amoxicillin was as effective as ampicillin when administered at half the dose of ampicillin.
VerwendenAmoxicillin trihydratesemi-synthetic antibiotic related to Penicillin which has antibacterial poperties. It is used for treatment of a variety of bacterial infections. It is used as a pharmaceutical product as a antibiotic agent, anti-infective drug raw materials.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Nachgelagerte Produkte
Anbieter50 Anbieter
Ergänzende Hinweise
DefinitionChEBI: A hydrate that is the trihydrate form of amoxicillin; a semisynthetic antibiotic, used either alone or in combination with potassium clavulanate (under the trade name Augmentin) for treatment of a variety of bacterial infections.
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