Anhydro Chlortetracycline Hydrochloride

HCID 54710411CAS 65490-24-6

基本情報

標準SMILES: Cc1c2c(c(O)c3c(O)ccc(Cl)c13)C(=O)[C@]1(O)C(O)=C(C(N)=O)C(=O)[C@@H](N(C)C)[C@@H]1C2.Cl
InChIKey: ISGAAFMBTIWTEU-DTTSPEASSA-N
分子式: C22H22Cl2N2O7
平均分子量: 497.3 g/mol
単同位体質量: 496.0804064

名称と識別子

優先名称: Anhydro Chlortetracycline Hydrochloride
IUPAC: (4S,4aS,12aR)-7-chloro-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-6-methyl-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide;hydrochloride
英語名: Anhydrochlortetracycline hydrochloride, CAN be used as secondary standard
分子式: C22H21ClN2O7.ClH
分子量: 497.33

名称と別名

65490-24-6Anhydro Chlortetracycline HydrochlorideAnhydrochlortetracycline (hydrochloride)(4S,4aS,12aR)-7-chloro-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-6-methyl-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide;hydrochlorideANHYDROCHLORTETRACYCLINE HYDROCHLORIDE, CAN BE USED AS SECONDARY STANDARDDBT5FQF96LAnhydro chlortetracycline HClC22H22Cl2N2O7MSK4129ASCHEMBL19742885DTXSID20716136MFCD00143616

名称をさらに表示

Aureomycin EP impurity LAnhydrochlortetracycline HClAnhydroaureoMycin HydrochlorideTetracycline Anhydro Chloro HClAnhydrochlortetracyline HydrochlorideAnhydrochlortetracycline hydrochloride in methanol(4S,4aS,12aS)-7-Chloro-4-(diMethylaMino)-1,4,4a,5,12,12a-hexahydro-3,10,11,12a-tetrahydroxy-6-Methyl-1,12-dioxo-2-naphthacenecarboxaMide Hydrochloride[4S-(4α,4aα,12aα)]-7-Chloro-4- (diMethylaMino)-1,4,4a,5,12,12a-hexahydro-3,10,11,12a-tetrahydroxy-6-Methyl-1,12-dioxo-2-naphthacenecarboxaMide Hydrochloride

AA17922PD044348HY-137196CS-0137013ST50826391G90912(4S,12aS,4aS)-4-(dimethylamino)-7-chloro-3,10,11,12a-tetrahydroxy-6-methyl-1,1 2-dioxo-4,5,12a,4a-tetrahydronaphthacene-2-carboxamide, chloride(4S,4aS,12aR)-7-Chloro-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-6-methyl-3,12-dioxo-3,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide--hydrogen chloride (1/1)

データベース識別子

CAS: 65490-24-6
PubChem CID: 54710411
DTXSID: DTXSID20716136
UNII: DBT5FQF96L

物性

構造計算による物性

極性表面積: 161 Å²
水素結合供与体数: 6
水素結合受容体数: 8
回転可能結合数: 2
重原子数: 33
形式電荷: 0
複雑度: 892

物理化学的性質

融点: 250 °C · >250°C
溶解性: DMF: soluble; DMSO: soluble; Ethanol: soluble; Methanol: soluble
外見: A solid
安定性: Light Sensitive, Temperature Sensitive

化学的性質

化学的特性orange to red-brown crystalline powder

化学と産業

応用分野

使用Anhydrochlortetracycline is the anhydro analogue and impurity of Chlortetracycline (C426500). Anhydrochlortetracycline is an antimicrobial and antibacterial.

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