Fmoc-Thr(α-Ac3GalNAc)-OtBu | 120173-56-0
中文名称
——
中文别名
——
英文名称
Fmoc-Thr(α-Ac3GalNAc)-OtBu
英文别名
tert-butyl (2S,3R)-3-[(2S,3R,4R,5R,6R)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)butanoate
CAS
120173-56-0
化学式
C37H46N2O13
mdl
——
分子量
726.778
InChiKey
MXDXWMQDZUVOIK-XCYCQXQLSA-N
BEILSTEIN
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EINECS
——
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物化性质
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计算性质
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ADMET
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安全信息
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SDS
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制备方法与用途
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上下游信息
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文献信息
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表征谱图
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同类化合物
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相关功能分类
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相关结构分类
物化性质
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沸点：851.8±65.0 °C(Predicted)
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密度：1.30±0.1 g/cm3(Predicted)
计算性质
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辛醇/水分配系数(LogP)：3.3
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重原子数：52
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可旋转键数：18
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环数：4.0
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sp3杂化的碳原子比例：0.51
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拓扑面积：191
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氢给体数：2
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氢受体数：13
上下游信息
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上游原料
中文名称 英文名称 CAS号 化学式 分子量 —— N-[(9H-fluoren-9-ylmethoxy)carbonyl]-O-(3,4,6-tri-O-acetyl-2-azido-2-deoxy-α-D-galactopyranosyl)-L-threonine-tert-butyl ester 120791-77-7 C35H42N4O12 710.738 —— O-(Acetoacetyl)-N-(9-fluorenylmethoxycarbonyl)-L-threonin-tert-butylester 120792-32-7 C27H31NO7 481.546 —— O-(Acetoacetyl)-N-(9-fluorenylmethoxycarbonyl)-L-threonin 120791-75-5 C23H23NO7 425.438 Nα-[(9H-芴-9-基甲氧基)羰基]-L-苏氨酸叔丁酯 N-fluorenylmethoxycarbonyl-threonine-tert-butyl ester 120791-76-6 C23H27NO5 397.471 —— 3,4,6-tri-O-acetyl-2-azido-2-deoxy-D-galactopyranosyl trichloroacetimidate 167939-15-3 C14H17Cl3N4O8 475.67 2-叠氮-D-半乳糖四乙酸酯 1,3,4,6-tetra-O-acetyl-2-azido-2-deoxy-D-galactopyranose 84278-00-2 C14H19N3O9 373.32 —— 3,4,6-tri-O-acetyl-2-azido-2-deoxy-α/β-D-galactopyranosyl nitrate 196398-25-1 C12H16N4O10 376.28 —— 3,4,6-tri-O-acetyl-2-azido-2-deoxy-α-D-galactopyranosyl nitrate 68733-05-1 C12H16N4O10 376.28 -
下游产品
中文名称 英文名称 CAS号 化学式 分子量 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 N-(9H-fluoren-9-yl)methoxycarbonyl-O-(3,4,6-tri-O-acetyl-2-acetamido-2-deoxy-α-D-galactopyranosyl)-L-threonine 116783-35-8 C33H38N2O13 670.67 —— Nα-(fluoren-9-ylmethoxycarbonyl)-O-[O-(2',3',4',6'-tetra-O-acetyl-β-D-galactopyranosyl)-(1->3)-2-acetamido-4,6-di-O-acetyl-2-deoxy-α-D-galactopyranosyl]-L-threonine tert-butyl ester 195976-10-4 C49H62N2O21 1015.03 —— Nα-fluoren-9-ylmethoxycarbonyl-O-[O-(2',3',4',6'-tetra-O-acetyl-β-D-galactopyranosyl)-(1->3)-2-acetamido-4,6-di-O-acetyl-2-deoxy-α-D-galactopyranosyl]-L-threonine 125760-33-0 C45H54N2O21 958.925 —— N-Fmoc-(O-N-acetylgalactosaminyl)threonine tert-butyl ester 189561-75-9 C31H40N2O10 600.666 —— O-(2-Acetamido-3,4,6-tri-O-acetyl-2-desoxy-α-D-galactopyranosyl)-N-(9-fluorenylmethoxycarbonyl)-L-threonyl-O-(2-acetamido-3,4,6-tri-O-acetyl-2-desoxy-α-D-galactopyranosyl)-L-serin-tert-butylester 120173-62-8 C54H70N4O23 1143.16 —— methyl (2R,4S,5R,6R)-5-acetamido-2-[[(2R,3R,4R,5R,6S)-5-acetamido-3,4-diacetyloxy-6-[(2R,3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]oxyoxan-2-yl]methoxy]-4-acetyloxy-6-[(1S,2R)-1,2,3-triacetyloxypropyl]oxane-2-carboxylate 189561-81-7 C55H71N3O24 1158.17 —— O-(2-Acetamido-3,4,6-tri-O-acetyl-2-desoxy-α-D-galactopyranosyl)-N-(9-fluorenylmethoxycarbonyl)-L-threonyl-L-alanin-tert-butylester 120173-85-5 C40H51N3O14 797.857 —— methyl (2R,4S,5R,6R)-5-acetamido-2-[[(2R,3R,4R,5R,6S)-5-acetamido-6-[(2R,3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-acetyloxy-6-[(1S,2R)-1,2,3-triacetyloxypropyl]oxane-2-carboxylate 189561-76-0 C51H67N3O22 1074.1 —— O-(2-Acetamido-3,4,6-tri-O-acetyl-2-desoxy-α-D-galactopyranosyl)-N-(9-fluorenylmethoxycarbonyl)-L-threonyl-O-tert-butyl-L-seryl-O-tert-butyl-L-serin-tert-butylester 120792-01-0 C51H72N4O17 1013.15 —— N-(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-thr