Benzoic acid,4,5-dimethoxy-2-((2-methoxy-1-oxo-2-propenyl)amino)-,3'(12)-ester with methyl(8-((4,6-dideoxy-2-O-(2,4-dideoxy-3-O-methyl-4-((1-methylethyl)amino)-alph a-L-threo-pentopyranosyl)-4-(((2,6-dideoxy-4-S-methyl-4-thio-beta-D-ribo-hexopyranos yl)oxy)amino)-beta-D-glucopyranosyl)oxy)-12-((2,6-dideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-1-h ydroxy-13-(2-(methyltrithio)ethylidene)-11-oxobicyclo(7.3.1)trideca-4,9-diene-2,6 -diyn-10-yl) carbamate,(1S-(1R*,4Z,8S*,12S*,13E))-

CAS 99674-26-7 MFCD00891651

化学结构图

99674-26-7
SMILES: CC(C)N[C@H]1CO[C@H](C[C@@H]1OC)O[C@H]1[C@H](O[C@H]2C#CC=CC#C[C@]3(O)[C@H](O[C@@H]4C[C@@H](OC(=O)C5C=C(OC)C(=CC=5NC(=O)C(=C)OC)OC)[C@@H](O)[C@@H](C)O4)C(=O)C(NC(=O)OC)=C2/C/3=C\CSSSC)O[C@H](C)[C@@H](NO[C@H]2C[C@H](O)[C@H](SC)[C@@H](C)O2)[C@@H]1O

化学属性

Mol. FormulaC59H80N4O22S4
Mol. Weight1325.67

别名和识别编码

Chemical NameBenzoic acid,4,5-dimethoxy-2-((2-methoxy-1-oxo-2-propenyl)amino)-,3'(12)-ester with methyl(8-((4,6-dideoxy-2-O-(2,4-dideoxy-3-O-methyl-4-((1-methylethyl)amino)-alph a-L-threo-pentopyranosyl)-4-(((2,6-dideoxy-4-S-methyl-4-thio-beta-D-ribo-hexopyranos yl)oxy)amino)-beta-D-glucopyranosyl)oxy)-12-((2,6-dideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-1-h ydroxy-13-(2-(methyltrithio)ethylidene)-11-oxobicyclo(7.3.1)trideca-4,9-diene-2,6 -diyn-10-yl) carbamate,(1S-(1R*,4Z,8S*,12S*,13E))-
Synonym BMY 28175 Esperamicin A(sub 1)
CAS Number99674-26-7
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安全信息

RTECSDG8717000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 26 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JANTAJ Journal of Antibiotics.  (Japan Antibiotics Research Assoc., 2-20-8
   Kamiosaki, Shinagawa-ku, Tokyo, 141, Japan)  V.2-5, 1948-52;  V.21- 1968-
   Volume(issue)/page/year: 44,1306,1991

系列性分类

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