(2S,3R)-3-{[(2S,3R,4R,5R,6R)-3-Acetamido-4,5-diacetoxy-6-(acetoxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}butanoic acid（CAS号：116783-35-8）

N-芴甲氧羰基-O-beta-(2-乙酰氨基-2-脱氧-3,4,6-三-O-乙酰基-alpha-D-吡喃半乳糖基)-L-苏氨酸

基本信息

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CAS号

116783-35-8

分子式

C33H38N2O13

分子量

670.67 g/mol

化学分类

基础化工原料有机化学品羧酸类

基础化工原料有机化学品酯类

基础化工原料有机化学品醚类

基础化工原料有机化学品杂环化合物

医药化工医药中间体杂环中间体

精细化工产品染料和颜料有机染料

精细化工产品表面活性剂阴离子表面活性剂

实验室化学品科研化学品生化试剂

基本物理性质

熔点

178-183 °C

SMILES

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CC(C(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)OC4C(C(C(C(O4)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C

InChI

InChI=1S/C33H38N2O13/c1-16(27(31(40)41)35-33(42)44-14-25-23-12-8-6-10-21(23)22-11-7-9-13-24(22)25)45-32-28(34-17(2)36)30(47-20(5)39)29(46-19(4)38)26(48-32)15-43-18(3)37/h6-13,16,25-30,32H,14-15H2,1-5H3,(H,34,36)(H,35,42)(H,40,41)/t16-,26-,27+,28-,29+,30-,32+/m1/s1

InChIKey

OXLCJWGAUPPZQJ-ZNHCDWFHSA-N

LogP

2.0394999999999994

拓扑极性表面积

202.08999999999997 Å²

氢键供体/受体

3 / 15

复杂度

1170

同义词与引用数据

英文

Fmoc-Thr[GalNAc(Ac)3-alpha-D]-OH
Fmoc-Thr[GalNAc(Ac)3-(c) paragraph sign-D]-OH
N--Fmoc-O--(2-acetamido-2-deoxy-3,4,6-tri-O-acetyl--D-galactopyranosyl)-L-threonine
116783-35-8
L-Threonine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-O-[3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-alpha-D-galactopyranosyl]-
N-(((9H-Fluoren-9-yl)methoxy)carbonyl)-O-((2S,3R,4R,5R,6R)-3-acetamido-4,5-diacetoxy-6-(acetoxymethyl)tetrahydro-2H-pyran-2-yl)-L-threonine
N-alpha-(9-Fluoroenyloxycarbonyl)-o-(2-acetamido-2deoxy-3,4,6-tri-o-acetyl-alpha-d-galactopyranosyl)-l-threonine
N-alpha-(9-Fluorenylmethyloxycarbonyl)-O-(2-acetamido-2deoxy-3,4,6-tri-O-acetyl-alpha-D-galactopyranosyl)-L-threonine (Fmoc-L-Thr(alpha-D-GalNAc(Ac)3)-OH)
Fmoc-Thr(GalNAc(Ac)3-
Fmoc-Thr[GalNAc(Ac)3-alpha-D]-OH, 97%
A-D]-OH
MFCD00171374
SCHEMBL1737712
(2S,3R)-2-(((9H-fluoren-9-yl)methoxy)carbonylamino)-3-((2S,3R,4R,5R,6R)-3-acetamido-4,5-diacetoxy-6-(acetoxymethyl)tetrahydro-2H-pyran-2-yloxy)butanoic acid
W-200901
2-Acetamido-3,4,6-tri-O-acetyl-2-deoxy-a-D-galactopyranosyl-Fmoc threonine
(2S,3R)-3-[(2S,3R,4R,5R,6R)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)butanoic acid
ZINC77292789
A-D)-OH
ZINC77292789(Fmoc-Thr(galnac(Ac)3-alpha-D)-OH)
EX-A3842
N-alpha-(fluoren-9-ylmethoxycarbonyl)-O-(2-acetamido-2-deoxy-3,4,6-tri-O-acetyl-alpha-D-galactopyranosyl)-L-threonine
Fmoc-Thr[GalNAc(Ac)3-
AKOS030530581
Fmoc-Thr(Ac?AcNH-alpha-Gal)-OH
HY-P0232
FMOC-THR(GALNAC(AC)3-ALPHA-D)-OH
CS-6902
Fmoc-Thr(galnac(Ac)3-alpha-D)-OH
N-Fmoc-O-beta-(2-acetamido-2-deoxy-3,4,6-tri-O-acetyl-alpha-D-galactopyranosyl)-L-threonine
N-Alpha-(9-Fluoroenyloxycarbonyl)-o-(2-Acetamido-2Deoxy-3,4,6-Tri-o-Acetyl-Alpha-d-Galactopyranosyl)-l-Threonine