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交沙霉素 | 16846-24-5

交沙霉素
josamycin
16846-24-5
C42H69NO15
827.99496
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:交沙霉素结构式
5282165
交沙霉素价格
简介
Josamycin (EN-141) 是一种大环内酯类抗生素,对多种病原体, 比如细菌 (bacteria) 具有抗菌活性。 Josamycin (EN-141) 对核糖体的解离常数 Kd 为 5.5 nM。
名称和标识符
MDL MFCD00210320
InChIKey XJSFLOJWULLJQS-XRUKWLHHSA-N
Inchi InChI=1S/C42H69NO15/c1-23(2)19-32(47)56-40-27(6)53-34(22-42(40,8)50)57-37-26(5)54-41(36(49)35(37)43(9)10)58-38-29(17-18-44)20-24(3)30(46)16-14-12-13-15-25(4)52-33(48)21-31(39(38)51-11)55-28(7)45/h12-14,16,18,23-27,29-31,34-41,46,49-50H,15,17,19-22H2,1-11H3/t24-,25-,26-,27+,29+,30+,31-,34+,35-,36-,37-,38+,39+,40+,41+,42-/m1/s1
SMILES O[C@H]1[C@](O[C@H](C)[C@@H](O[C@@](O[C@@H](C)[C@@H]2OC(CC(C)C)=O)([H])C[C@]2(O)C)[C@@H]1N(C)C)([H])O[C@@H]([C@H](C[C@H]([C@H](/C=C/C=C/C3)O)C)CC=O)[C@H]([C@](CC(O[C@@H]3C)=O)([H])OC(C)=O)OC
别名信息
- 中文别名 -
  • 交沙霉素
  • 角沙霉素
  • (S,R)-盐酸帕洛诺司琼
  • 2-(1H-5-吡唑基)噻唑
  • 交沙霉素 EP标准品
  • 交沙霉素 标准品
  • 交沙霉素峰鉴别 EP标准品
  • 交沙霉素,Josamycin ,分析标准品
  • 交沙毒素
  • 交沙霉素溶液,100PPM
  • 交沙霉素溶液, 1000PPM
  • 交沙霉素溶液, 100UG/ML 甲醇溶液
  • 交沙霉素溶液, 1000UG/ML 甲醇溶液
  • 交沙霉素峰鉴别标准品
- 英文别名 -
  • josamycin
  • Josamycin solution
  • Leucomycin A3
  • carbomycin B
  • EN 141
  • Iosalide
  • Jomybel
  • Josacine
  • Josamina
  • Vilprafen
  • Wilprafen
  • YL-704A3
  • Kitasamycin A3
  • Turimycin A5
  • C12662
  • Josamycin
  • Josamycin, >=98.0% (UV)
  • CHEMBL224436
  • [(2S,3S,4R,6S)-6-[(2R,3S,4R,5R,6S)-6-[[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-4-acetoxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyl-tetrahydropyran-3-yl]oxy-4-hydroxy-2,4-dimethyl-tetrahydropyran-3-yl] 3-methylbutanoate
  • [(2S,3S,4R,6S)-6-[(2R,3S,4R,5R,6S)-6-[[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-4-acetyloxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-(dimethylamino)-5-
  • D01235
  • JOSAMYCIN [INN]
  • 16846-24-5
  • Stereoisomer of 4-(acetyloxy)-6-((3,6-dideoxy-4-O-(2,6-dideoxy-3-C-methyl-4-O-(3-methyl-1-oxobutyl)-alpha-L-ribo-hexopyranosyl)-3-(dimethylamino)-beta-D-glucopyranosyl)oxy)-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxooxacyclohexadeca-11,13-diene-7-acetaldehyde
  • Josamycin (JP17/USAN/INN)
  • Stereoisomer of 7-(formylmethyl)-4,10-dihydroxy-5-methoxy-9,16-dimethyl-2-oxooxacyclohexadeca-11,13-dien-6-yl 3,6-dideoxy-4-O-(2,6-dideoxy-3-C-methyl-alpha-L-ribo-hexopyranosyl)-3-(dimethylamino)-beta-D-glucopyranoside 4'-acetate 4'-isovalerate
  • CS-0013975
  • Leucomycin V 3-acetate 4b-(3-methylbutanoate)
  • Josamycine [INN-French]
  • EN-141
  • Kitasamycin A3
  • Leucomycin A3
  • Turimycin A5
  • Josamycin for peak identification, European Pharmacopoeia (EP) Reference Standard
  • Josamycin (TN)
  • Josamycin, European Pharmacopoeia (EP) Reference Standard
  • 6-{6-[3-Acetyloxy-13-hydroxy-2-methoxy-7,14-dimethyl-6-oxa-5-oxo-16-(2-oxoethyl)cyclohexadeca-9,11-dienyloxy]-4-(dimethylamino)-5-hydroxy-2-methylperhydro-2H-pyran-3-yloxy}-4-hydroxy-2,4-dimethylperhydro-2H-pyran-3-yl 3-methylbutanoate
  • Josamycin
  • (4R,5S,6S,7R,9R,10R,11E,13E,16R)-4-(acetyloxy)-6-[[3,6-dideoxy-4-O-[2,6-dideoxy-3-C-methyl-4-O-(3-methylbutanoyl)-a-l-ribo-hexopyranosyl]-3-(dimethylamino)-ss-d-glucopyranosyl]oxy]-10-hydroxy-5-methoxy-9,16-dimethyl-7-(2-oxoethyl)oxacyclohexadeca-11,13-dien-2-one
  • Josamycinum
  • Leucomycin V, 3-acetate 4(sup beta)-(3-methylbutanoate)
  • NSC122223
  • HV13HFS217
  • leucomycin V 3-acetate 4(B)-(3-methylbutanoate)
  • JOSAMYCIN [USAN]
  • [(2S,3S,4R,6S)-6-[(2R,3S,4R,5R,6S)-6-[[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-4-acetyloxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] 3-methylbutanoate
  • Josamicina
  • iosalide
  • JOSAMYCIN [MART.]
  • SCHEMBL132829
  • GTPL12924
  • JOSAMYCIN [MI]
  • hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] 3-methylbutanoate
  • Leucomycin A3 (>90%)
  • Antibiotic yl-704 A3
  • Josamycine
  • Josamicina [INN-Spanish]
  • Leucomycin V, 3-acetate 4(sup B)-(3-methylbutanoate)
  • JM
  • Leucomycin V 3-acetate 4(beta)-(3-methylbutanoate)
  • leucomycin V 3-acetate 4beta-(3-methylbutanoate)
  • Josamycin [USAN:INN:BAN:JAN]
  • josamina
  • JOSAMYCIN [WHO-DD]
  • Stereoisomer of 7-(formylmethyl)-4,10-dihydroxy-5-methoxy-9,16-dimethyl-2-oxooxacyclohexadeca-11,13-dien-6-yl 3,6-dideoxy-4-O-(2,6-dideoxy-3-C-methyl-alpha-L-ribo-hexopyranosyl)-3-(dimethylamino)-beta-D-glucopyranoside 4'-acetate 4''-isovalerate
  • s4421
  • Josamycin 10 microg/mL in Acetonitrile
  • Q423369
  • EINECS 240-871-6
  • HY-B1920
  • SR-01000883731
  • (2S,3S,4R,6S)-6-{[(2R,3S,4R,5R,6S)-6-{[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-4-(acetyloxy)-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy}-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy}-4-hydroxy-2,4-dimethyloxan-3-yl 3-methylbutanoate
  • XJSFLOJWULLJQS-NGVXBBESSA-N
  • 56689-45-3
  • EN-141
  • [(2S,3S,4R,6S)-6-[(2R,3S,4R,5R,6S)-6-[[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-4-acetyloxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-dimethylamino-5-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] 3-methylbutanoate
  • JOSAMYCIN [EP MONOGRAPH]
  • UNII-HV13HFS217
  • JOSAMYCIN [JAN]
  • SR-01000883731-1
  • DB01321
  • LEUCOMYCIN V, 3-ACETATE 4(SUP .BETA.)-(3-METHYLBUTANOATE)
  • MFCD00210320
  • ST075007
  • Josamycin 1000 microg/mL in Acetonitrile
  • Josamycinum [INN-Latin]
  • Yl-704 A3
  • CHEBI:31739
  • CCRIS 8511
  • JOSAMYCIN
  • leucomycin V 3-acetate 4B-(3-methylbutanoate)
  • leucomycin V 3-acetate 4B-(3-methylbutanoate)
  • antibiotic yl-704 A3
  • antibiotic yl-704 A3
  • leucomycin A3
  • leucomycin A3
  • kitasamycin A3
  • kitasamycin A3
  • turimycin A5
  • turimycin A5
  • leucomycin V 3-acetate 4(beta)-(3-methylbutanoate)
  • leucomycin V 3-acetate 4(beta)-(3-methylbutanoate)
  • Antibiotic YL 704A3
  • Antibiotic YL 704A3
  • Josamycin for peak identification
物化性质
实验特性
LogP 3.01340
PSA 206.05000
Merck 13,5286
折射率 1.6220 (estimate)
沸点 763.27°C (rough estimate)
熔点 131.5 ºC
闪点 484.7°C
溶解度 微溶 (2.8 g/L) (25 ºC),
颜色与性状 未确定
溶解性 未确定
酸度系数(pKa) 7.1 (40% aq methanol)
比旋光度 D25 -70° (c = 1 in ethanol)
密度 1.20±0.1 g/cm3 (20 ºC 760 Torr),
计算特性
精确分子量 827.46700
氢键供体数量 3
氢键受体数量 16
可旋转化学键数量 14
同位素质量 827.467
重原子数量 58
复杂度 1390
同位素原子数量 0
确定原子立构中心数量 16
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) 2.9
互变异构体数量 2
表面电荷 0
拓扑分子极性表面积 206A^2
国际标准相关数据
EINECS 240-871-6
专业数据库参考
PubChemId 5282165
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