2-Acetamido-3-O-(2,3,4,6-tetra-O-acetyl-b-D-galactopyranosyl)-4,6-di-O-acetyl-2-deoxy-a-D-galactopyranosyl-Fmoc-L- serine（CAS番号：125760-30-7）

2-Acetamido-3-O-(2,3,4,6-tetra-O-acetyl-b-D-galactopyranosyl)-4,6-di-O-acetyl-2-deoxy-a-D-galactopyranosyl-Fmoc-L- serine

基本情報

編集器で閲覧

CAS番号

125760-30-7

分子式

C44H52N2O21

分子量

944.88 g/mol

化学分類

基礎化学原料有機化学品カルボン酸類

基礎化学原料有機化学品エステル類

基礎化学原料有機化学品エーテル類

基礎化学原料有機化学品複素環化合物

医薬化学品医薬中間体複素環中間体

精密化学品染料および顔料有機染料

精密化学品界面活性剤アニオン性界面活性剤

実験室化学品研究用化学品生化学試薬

基本的な物理特性

SMILES

編集器で閲覧

O([C@H]1[C@@H]([C@H]([C@H]([C@@H](COC(C)=O)O1)OC(C)=O)OC(C)=O)OC(C)=O)[C@H]1[C@H]([C@@H](COC(C)=O)O[C@@H]([C@@H]1NC(C)=O)OC[C@@H](C(=O)O)NC(=O)OCC1C2C=CC=CC=2C2=CC=CC=C12)OC(C)=O

InChI

1S/C44H52N2O21/c1-20(47)45-35-38(67-43-40(64-26(7)53)39(63-25(6)52)37(62-24(5)51)34(66-43)19-58-22(3)49)36(61-23(4)50)33(18-57-21(2)48)65-42(35)59-17-32(41(54)55)46-44(56)60-16-31-29-14-10-8-12-27(29)28-13-9-11-15-30(28)31/h8-15,31-40,42-43H,16-19H2,1-7H3,(H,45,47)(H,46,56)(H,54,55)/t32-,33+,34+,35+,36-,37-,38+,39-,40+,42-,43-/m0/s1

InChIKey

JIIREWDIFSHWID-CYAMVCNPSA-N

LogP

1.187600000000011

トポロジカル極性表面積

299.45 Å²

水素結合ドナー/アクセプター

3 / 23

複雑度

1790

同義語と引用データ

英語

Fmoc-L-Ser[alpha-(Gal-beta(1-3)-GalNAc)]-OH peracetate
2-Acetamido-3-O-(2,3,4,6-tetra-O-acetyl-b-D-galactopyranosyl)-4,6-di-O-acetyl-2-deoxy-a-D-galactopyranosyl-Fmoc-L- serine
O-[4,6-Di-O-acetyl-2-(acetylamino)-2-deoxy-3-O-(2,3,4,6-tetra-O-acetyl-beta-D-galactopyranosyl)-alpha-D-galactopyranosyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-serine
Fmoc-L-Ser(TF)-OH
(2S)-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)propanoic acid
L-Serine, O-[4,6-di-O-acetyl-2-(acetylamino)-2-deoxy-3-O-(2,3,4,6-tetra-O-acetyl-
A-D-galactopyranosyl)-
A-D-galactopyranosyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-
O-[3-O-(2-O,3-O,4-O,6-O-Tetraacetyl-beta-D-galactopyranosyl)-4-O,6-O-diacetyl-2-(ace
N-(9H-fluoren-9-ylmethoxycarbonyl)-O-[O-(2',3',4',6'-tetra-O-acetyl-β-D-galactopyranosyl)-(1,3)-2-acetamido-4,6-di-O-acetoxy-2-deoxy-α-D-galactopyranosyl]-L-serine
Fmoc-L-Ser[α-(Gal-β(1-3)-GalNAc)]-OH peracetate
L-Serine, 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-Ser (Gal β(1-3)Gal- NAc)-OH, peracetate
Fmoc-Ser(Ac4Galβ1-3Ac2GalNAcα)-OH