125760-33-0 (L-Threonine,O-[4,6-di-O-acetyl-2-(acetylamino)-2-deoxy-3-O-(2,3,4,6-tetra-O-acetyl-b-D-galactopyranosyl)-a-D-galactopyranosyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-,L-Threonine,O-[4,6-di-O-acetyl-2-(acetylamino)-2-deoxy-3-O-(2,3,4,6-tetra-O-acetyl-b-D-galactopyranosyl)-a-D-galactopyranosyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-)

CAS号:
125760-33-0
中文名称:
L-Threonine,O-[4,6-di-O-acetyl-2-(acetylamino)-2-deoxy-3-O-(2,3,4,6-tetra-O-acetyl-b-D-galactopyranosyl)-a-D-galactopyranosyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-
英文名称:
L-Threonine,O-[4,6-di-O-acetyl-2-(acetylamino)-2-deoxy-3-O-(2,3,4,6-tetra-O-acetyl-b-D-galactopyranosyl)-a-D-galactopyranosyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-
分子式:
C45H54N2O21
分子量:
958.911075115204

L-Threonine,O-[4,6-di-O-acetyl-2-(acetylamino)-2-deoxy-3-O-(2,3,4,6-tetra-O-acetyl-b-D-galactopyranosyl)-a-D-galactopyranosyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-(125760-33-0)名称与标识符

名称

英文别名:
Fmoc-L-Thr[alpha-(Gal-beta(1-3)-GalNAc)]-OH peracetate;Fmoc-L-Thr[α-(Gal-β(1-3)-GalNAc)]-OH peracetate;L-Threonine, O-[4,6-di-O-acetyl-2-(acetylamino)-2-deoxy-3-O-(2,3,4,6-tetra-O-acetyl-β-D-galactopyranosyl)-α-D-galactopyranosyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-;Fmoc-Thr(Ac4Galβ1-3Ac2GalNAcα)-OH;125760-33-0;O-[4,6-Di-O-acetyl-2-(acetylamino)-2-deoxy-3-O-(2,3,4,6-tetra-O-acetyl-I(2)-D-galactopyranosyl)-I+/--D-galactopyranosyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-threonine;L-Threonine, O-[4,6-di-O-acetyl-2-(acetylamino)-2-deoxy-3-O-(2,3,4,6-tetra-O-acetyl-;A-D-galactopyranosyl)-;(2S,3R)-3-[(2S,3R,4R,5R,6R)-3-Acetamido-5-acetyloxy-6-(acetyloxymethyl)-4-[(2R,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)butanoic acid;A-D-galactopyranosyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-;DTXSID401099486;

标识符

MDL:
MFCD00167470
InChIKey:
ZSSXZUSKVRRKAI-UJEKEGALSA-N
Inchi:
1S/C45H54N2O21/c1-20(35(42(55)56)47-45(57)60-17-32-30-15-11-9-13-28(30)29-14-10-12-16-31(29)32)61-43-36(46-21(2)48)39(37(62-24(5)51)33(66-43)18-58-22(3)49)68-44-41(65-27(8)54)40(64-26(7)53)38(63-25(6)52)34(67-44)19-59-23(4)50/h9-16,20,32-41,43-44H,17-19H2,1-8H3,(H,46,48)(H,47,57)(H,55,56)/t20-,33+,34+,35-,36+,37-,38-,39+,40-,41+,43-,44-/m0/s1
SMILES:
C1(COC(=O)N[C@H](C(=O)O)[C@H](C)O[C@H]2O[C@@H]([C@H](OC(=O)C)[C@H](O[C@H]3[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](COC(C)=O)O3)[C@H]2NC(=O)C)COC(=O)C)C2C=CC=CC=2C2C=CC=CC1=2

L-Threonine,O-[4,6-di-O-acetyl-2-(acetylamino)-2-deoxy-3-O-(2,3,4,6-tetra-O-acetyl-b-D-galactopyranosyl)-a-D-galactopyranosyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-(125760-33-0)物化性质

计算特性

  • 精确分子量 : 958.32190674g/mol
  • 氢键供体数量 : 3
  • 氢键受体数量 : 21
  • 可旋转化学键数量 : 25
  • 同位素质量 : 958.32190674g/mol
  • 重原子数量 : 68
  • 复杂度 : 1820
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 12
  • 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) : 1.6
  • 拓扑分子极性表面积 : 299Ų

L-Threonine,O-[4,6-di-O-acetyl-2-(acetylamino)-2-deoxy-3-O-(2,3,4,6-tetra-O-acetyl-b-D-galactopyranosyl)-a-D-galactopyranosyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-(125760-33-0)推荐厂家 更多厂家(5)

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四川维克奇生物科技有限公司 13348961525杨洋 2851167780
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Ms. 张 1689452757
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