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螺旋霉素I标准溶液 | 24916-50-5

螺旋霉素I标准溶液
Spiramycin I Standard
24916-50-5
C43H74N2O14
843.052660000001
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:螺旋霉素I标准溶液结构式
5289394
简介
Spiramycin I 是一种大环内酯类抗生素和抗寄生虫药。
名称和标识符
MDL MFCD00242797
InChIKey ACTOXUHEUCPTEW-BTKFSUNJSA-N
Inchi InChI=1S/C43H74N2O14/c1-24-21-29(19-20-46)39(59-42-37(49)36(45(9)10)38(27(4)56-42)58-35-23-43(6,51)41(50)28(5)55-35)40(52-11)31(47)22-33(48)53-25(2)15-13-12-14-16-32(24)57-34-18-17-30(44(7)8)26(3)54-34/h12-14,16,20,24-32,34-42,47,49-51H,15,17-19,21-23H2,1-11H3/t24-,25-,26?,27?,28?,29+,30?,31-,32+,34?,35?,36?,37?,38?,39+,40+,41?,42?,43?/m1/s1
SMILES C[C@@H]1C[C@H](CC=O)[C@@H]([C@H]([C@@H](CC(=O)O[C@H](C)CC=CC=C[C@@H]1OC2CCC(C(C)O2)N(C)C)O)OC)OC3C(C(C(C(C)O3)OC4CC(C)(C(C(C)O4)O)O)N(C)C)O
别名信息
- 中文别名 -
  • 螺旋霉素I
  • 苯并- 3 ,4 -菲
  • 螺旋霉素Ⅰ
  • 螺旋霉素I标准品
  • 螺旋霉素I标准溶液
  • 螺旋霉素 I
- 英文别名 -
  • Leucomycin V,9-O-[(2R,5S,6R)-5-(dimethylamino)tetrahydro-6-methyl-2H-pyran-2-yl]-
  • Spiramycin I
  • 9-O-[(2R,5S,6R)-5-(Dimethylamino)tetrahydro-6-methyl-2H-pyran-2-yl]-leucomycin V
  • demycarosylturimycin H
  • Foromacidin A
  • Foromacidine A
  • Leucomycin V,9-o-((2R,5S,6R)-5-(dimethylamino)tetrahydro-6-methyl-2H-pyran-2-yl)
  • Spiramycin A
  • SPIRAMYCIN I STANDARD
  • Spiramycin-I
  • Spiramycin I Standard
  • Provamycin
  • Sequamycin
  • spiramycin
  • HY-100593
  • 033ECH6IFG
  • RP 5337
  • CHEMBL453514
  • IL-5902
  • CCG-270525
  • RP-5337
  • Rovamycin
  • SPIRAMYCIN I [MI]
  • Rovamicina
  • Formacidine
  • 2-[(4R, 5S, 6S, 7R, 9R, 10R, 11E, 13E, 16R)-6-[(2S, 3R, 4R, 5S, 6R)-5-[(2S, 4R, 5S, 6S)-4, 5-dihydroxy-4, 6-dimethyloxan-2-yl]oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[(2R, 5S, 6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy-4-hydroxy-5-methoxy-9, 16-dimethyl-2-oxo-1-oxacyclohexadeca-11, 13-dien-7-yl]acetaldehyde
  • 8025-81-8
  • Spiramycin I (Contains up to 6% Spiramycin III)
  • s5744
  • NSC-55926
  • Espiramicin
  • NSC-64393
  • Leucomycin V, 9-O-(5-(dimethylamino)tetrahydro-6-methyl-2H-pyran-2-yl)-, (9(2R,5S,6R))-
  • NSC-758472
  • Leucomycin V, 9-O-((2R,5S,6R)-5-(dimethylamino)tetrahydro-6-methyl-2H-pyran-2-yl)-
  • CS-8166
  • IL 5902
  • AB00514638
  • UNII-033ECH6IFG
  • AC-32598
  • [(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-{[(2S,3R,4R,5S,6R)-5-{[(2S,4R,5S,6S)-4,5-dihydroxy-4,6-dimethyltetrahydro-2H-pyran-2-yl]oxy}-4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-10-{[(2R,5S,6R)-5-(dimethylamino)-6-methyltetrahydro-2H-pyran-2-yl]oxy}-4-hydroxy-5-methoxy-9,16-dimethyl-2-oxooxacyclohexadeca-11,13-dien-7-yl]acetaldehyde (non-preferred name)
  • Rovamycine
  • DTXSID9023594
  • 24916-50-5
  • Leucomycin V, 9-O-[(2R,5S,6R)-5-(dimethylamino)tetrahydro-6-methyl-2H-pyran-2-yl]-
  • NSC55926
  • ACTOXUHEUCPTEW-OBURPCBNSA-N
  • AKOS037515744
  • Foromacidin
  • Q422265
  • 2-[(11E,13Z)-6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[5-(dimethylamino)-6-methyloxan-2-yl]oxy-4-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde
  • 2-[6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[5-(dimethylamino)-6-methyloxan-2-yl]oxy-4-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde
  • 2-[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[5-(dimethylamino)-6-methyloxan-2-yl]oxy-4-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]acet
  • spiramycin (undefined stereochemistry)
  • Q13023033
  • 2-[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[5-(dimethylamino)-6-methyloxan-2-yl]oxy-4-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde
  • BCP31237
  • FT-0657527
物化性质
实验特性
LogP 2.32510
PSA 195.38000
沸点 913.7±65.0 °C at 760 mmHg
熔点 134-1370C
蒸气压 0.0±0.6 mmHg at 25°C
闪点 506.4±34.3 °C
颜色与性状 白色至淡黄色粉末,味苦
比旋光度 D20 -96°
密度 1.2±0.1 g/cm3
计算特性
精确分子量 842.51400
氢键供体数量 4
氢键受体数量 16
可旋转化学键数量 11
同位素质量 842.51400504g/mol
重原子数量 59
复杂度 1370
同位素原子数量 0
确定原子立构中心数量 19
不确定原子立构中心数量 0
确定化学键立构中心数量 2
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) 2.1
拓扑分子极性表面积 195Ų
专业数据库参考
PubChemId 5289394
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