153088-71-2 ((D-Glucose, O-6-deoxy-a-L-galactopyranosyl-(1®4)-O-[3-O-sulfo-b-D-galactopyranosyl-(1®3)]-2-(acetylamino)-2-deoxy-)

CAS号:
153088-71-2
英文名称:
D-Glucose, O-6-deoxy-a-L-galactopyranosyl-(1®4)-O-[3-O-sulfo-b-D-galactopyranosyl-(1®3)]-2-(acetylamino)-2-deoxy-
分子式:
C20H35NO18S
分子量:
609.552807092667

D-Glucose, O-6-deoxy-a-L-galactopyranosyl-(1®4)-O-[3-O-sulfo-b-D-galactopyranosyl-(1®3)]-2-(acetylamino)-2-deoxy-(153088-71-2)名称与标识符

名称

英文别名:
[(2R,3R,4S,5S,6R)-2-[(2R,3R,4R,5S,6R)-3-acetamido-2-hydroxy-6-(hydroxymethyl)-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] hydrogen;3'-SULFATED LEWIS A;[3OSO3]Galbeta1-3(Fucalpha1-4)GlcNAcbeta;1fwv;3)]-2-(acetylamino)-2-deoxy-;3...;SGA-(1-3)MAG-(4-1)FUC;sulfo Lewis a;LEWIS-A TRISACCHARIDE 3'-SULFATE;3'-O-SULPHONATO-LEWISA SODIUM SALT;3'-O-SULFONATO LEWIS A, SODIUM SALT;3'-(SO3H)GAL-BETA1-3(FUC-ALPHA1-4)GLCNAC;3'-(O-SO3NA)GAL-BETA1,3(FUC-ALPHA1,4)GLCNAC, NA;3''-SULFATED LEWIS A [3''-(SO3H)GAL-SS1-3(FUC-ALPHA1-4)GLCNAC ]SULFO LEWIS A;alpha-L-fucopyranosyl-(1->4)-[3-O-sulfo-beta-D-galactopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-glucopyranose;alpha-L-Fuc-(1->4)-[beta-D-Gal3S-(1->3)]-beta-D-GlcNAc;alpha-L-Fucp-(1->4)-[beta-D-Galp3S-(1->3)]-beta-D-GlcpNAc;(3S)Galb1-3(Fuca1-4)GlcNAcb;Q27133695;153088-71-2;[(2R,3R,4S,5S,6R)-2-[(2R,3R,4R,5S,6R)-3-acetamido-2-hydroxy-6-(hydroxymethyl)-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] hydrogen sulfate;6-deoxy-alpha-L-galactopyranosyl-(1->4)-[3-O-sulfo-beta-D-galactopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-glucopyranose;CHEBI:65149;alpha-L-fucosyl-(1->4)-[3-O-sulfo-beta-D-galactosyl-(1->3)]-N-acetyl-beta-D-glucosamine;DTXSID60415358;(3S)Galbeta1-3(Fucalpha1-4)GlcNAcbeta;

标识符

InChIKey:
ABZKLZZRLAPTDK-JGMUFZQJSA-N
Inchi:
1S/C20H35NO18S/c1-5-10(25)12(27)13(28)19(34-5)37-15-8(4-23)35-18(30)9(21-6(2)24)16(15)38-20-14(29)17(39-40(31,32)33)11(26)7(3-22)36-20/h5,7-20,22-23,25-30H,3-4H2,1-2H3,(H,21,24)(H,31,32,33)/t5-,7+,8+,9+,10+,11-,12+,13-,14+,15+,16+,17-,18+,19-,20-/m0/s1
SMILES:
S(=O)(=O)(O)O[C@H]1[C@H]([C@@H](CO)O[C@H]([C@@H]1O)O[C@@H]1[C@H]([C@H](O)O[C@H](CO)[C@H]1O[C@H]1[C@H]([C@@H]([C@@H]([C@H](C)O1)O)O)O)NC(C)=O)O

D-Glucose, O-6-deoxy-a-L-galactopyranosyl-(1®4)-O-[3-O-sulfo-b-D-galactopyranosyl-(1®3)]-2-(acetylamino)-2-deoxy-(153088-71-2)物化性质

实验特性

  • LogP : -5.05530
  • PSA : 311.90000

计算特性

  • 精确分子量 : 645.15500
  • 氢键供体数量 : 10
  • 氢键受体数量 : 18
  • 可旋转化学键数量 : 9
  • 同位素质量 : 609.15748444g/mol
  • 重原子数量 : 40
  • 复杂度 : 950
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 15
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 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) : -6.2
  • 拓扑分子极性表面积 : 309Ų

D-Glucose, O-6-deoxy-a-L-galactopyranosyl-(1®4)-O-[3-O-sulfo-b-D-galactopyranosyl-(1®3)]-2-(acetylamino)-2-deoxy-(153088-71-2)推荐厂家 更多厂家(2)

公司名称手机号/电话联系人QQ微信询单
江苏永健医药科技有限公司 17701422016韩经理 3587493084
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上海瀚思化工有限公司 18939883912
021-34536277
顾经理 3003949364
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