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泰利霉素中间体 5A | 160145-82-4

泰利霉素中间体 5A结构式图片|160145-82-4结构式图片
泰利霉素中间体 5A
2 '-Obenzoyl-3-O-de (2,6-dideoxy-3-c-methyl-3-O-methyl-a-L-ribohexopyranosyl)oxy-11-deoxy-10,11-didehydro-6-O-methyl-3-oxoerythromycin
160145-82-4
C32H53NO10
611.76
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:泰利霉素中间体 5A结构式
11342861
名称和标识符
InChIKey ZHLSXNLCQSCHHR-JVQYYQIBSA-N
Inchi InChI=1S/C37H55NO10/c1-12-28-36(7,43)19-21(2)29(39)22(3)20-37(8,44-11)32(24(5)30(40)25(6)33(41)46-28)48-35-31(27(38(9)10)18-23(4)45-35)47-34(42)26-16-14-13-15-17-26/h13-17,19,22-25,27-28,31-32,35,43H,12,18,20H2,1-11H3/b21-19+/t22-,23-,24+,25-,27+,28-,31-,32-,35+,36+,37-/m1/s1
SMILES CC[C@@H]1[C@](O)(C)C=C(C)C(=O)[C@H](C)C[C@](OC)(C)[C@H](O[C@H]2[C@H](OC(C3=CC=CC=C3)=O)[C@@H](N(C)C)C[C@@H](C)O2)[C@@H](C)C(=O)[C@@H](C)C(=O)O1 |c:6,&1:2,3,11,14,18,20,21,31,36,39,43|
别名信息
- 中文别名 -
  • 泰利霉素中间体 5A
  • 泰利中间体(6A)
- 英文别名 -
  • 3-De[(2,6-dideoxy-3-C-methyl-3-O-methyl-a-L-ribo-hexopyranosyl)oxy]-10,11-didehydro-11-deoxy-6-O-methyl-3-oxo-erythromycin 2'-acetate
  • 2 ''-OBEZOYL-3-O-DE [(2,6-DIDEOXY-3-C-METHYL-3-O-METHYL-A-L-RIBOHEXOPYRANOSYL)OXY]-11-DEOXY-10,11-DIDEHYDRO-6-O-METHYL-3-OXO ERYTHROMYCIN
  • Telithromycin intermediate (6A)
  • 3-de[(2,6-dideoxy-3-c-methyl-3-o-methyl-a-l-ribo-hexopyranosyl)oxy]-10,11-didehydro-11-deoxy-6-o-methyl-3-oxo-erythromycin 2’-acetate
  • 2 ∧ -OBEZOYL -3-O-DE [(2, 6-DIDEOXY-3-C-METHYL-3-O-METHYL-α-L-RIBOHEXOPYRANOSYL)OXY]-11-DEOXY-10,11-DIDEHYDRO-6-O-METHYL-3-OXO ERYTHROMYCIN
  • 2’-OBEZOYL-3-O-DE[(2,6-DIDEOXY-3-C-METHYL-3-O-METHYL-ALPHA-L-RIBOHEXOPYRANOSYL)OXY]-11-DEOXY-10,11-DIDEHYDRO-6-O-METHYL-3-OXO-ERYTHROMYCIN
  • 2 ’’-OBEZOYL -3-O-DE [(2, 6-DIDEOXY-3-C-METHYL-3-O-METHYL-A-L-RIBOHEXOPYRANOSYL)OXY]-11-DEOXY-10,11-DIDEHYDRO-6-O-METHYL-3-OXO ERYTHROMYCIN
  • 2'-OBEZOYL-3-O-DE[(2,6-DIDEOXY-3-C-METHYL-3-O-METHYL-ALPHA-L-RIBOHEXOPYRANOSYL)OXY]-11-DEOXY-10,11-DIDEHYDRO-6-O-METHYL-3-OXO-ERYTHROMYCIN
  • 2 ''-OBEZOYL -3-O-DE [(2, 6-DIDEOXY-3-C-METHYL-3-O-METHYL-A-L-RIBOHEXOPYRANOSYL)OXY]-11-DEOXY-10,11-DIDEHYDRO-6-O-METHYL-3-OXO ERYTHROMYCIN
  • 3-De[(2,6-dideoxy-3-C-methyl-3-o-methyl-a-L-ribo-hexopyranosyl)oxy]-10,11-didehydro-11-deoxy-6-o-methyl-3-oxo-erythromycin 2'-acetate
  • 160145-82-4
  • [(2S,3R,4S,6R)-4-(Dimethylamino)-2-[[(3R,5R,6R,7R,9R,11E,13S,14R)-14-ethyl-13-hydroxy-7-methoxy-3,5,7,9,11,13-hexamethyl-2,4,10-trioxo-1-oxacyclotetradec-11-en-6-yl]oxy]-6-methyloxan-3-yl] benzoate
  • 3-DE[(2,6-DIDEOXY-3-C-METHYL-3-O-METHYL-A-L-RIBO-HEXOPYRANOSYL)OXY]-10,11-DIDEHYDRO-11-DEOXY-6-O-METHYL-3-OXO-ERYTHROMYCIN 2’-ACETATE
  • 3-de[(2,6-dideoxy-3-c-methyl-3-o-methyl-a-l-ribo-hexopyranosyl)oxy]-10,11-didehydro-11-deoxy-6-o-methyl-3-oxo-erythromycin 2'-acetate
物化性质
实验特性
LogP 4.53670
PSA 137.90000
密度 1.14
计算特性
精确分子量 673.38300
氢键供体数量 1
氢键受体数量 11
可旋转化学键数量 8
同位素质量 673.38259695g/mol
重原子数量 48
复杂度 1180
同位素原子数量 0
确定原子立构中心数量 11
不确定原子立构中心数量 0
确定化学键立构中心数量 1
不确定化学键立构中心数量 0
共价键单元数量 1
疏水参数计算参考值(XlogP) 5.1
拓扑分子极性表面积 138Ų
专业数据库参考
PubChemId 11342861
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