uspto-grants-2003_05 · 10.6084/m9.figshare.5104873.v1 · US06569993B1
查看HCID178459569
Glu(OtBu)-Arg(Pmc)-Val-Asp(Allyl)-OBzl
1-O-benzyl 4-O-prop-2-enyl (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoyl]amino]-5-[[amino-[(2,2,5,7,8-pentamethyl-3,4-dihydrochromen-6-yl)sulfonylamino]methylidene]amino]pentanoyl]amino]-3-methylbutanoyl]amino]butanedioate
C48H71N7O12S970.2 g/mol
IDENTITY
结构与身份
- 标准SMILES
- C=CCOC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)NS(=O)(=O)c1c(C)c(C)c2c(c1C)CCC(C)(C)O2)NC(=O)[C@@H](N)CCC(=O)OC(C)(C)C)C(C)C)C(=O)OCc1ccccc1
- InChIKey
- NUIGHKJGLOTHFS-FWIWLVIWSA-N
- 分子式
- C48H71N7O12S
- 平均分子量
- 970.2 g/mol
- 单同位素质量
- 969.4881419
COMPUTED
结构计算性质
- XLogP
- 4.6
- 极性表面积
- 294 Ų
- 氢键供体
- 6
- 氢键受体
- 14
- 可旋转键
- 28
- 重原子
- 68
- 形式电荷
- 0
- 复杂度
- 1,870
ALIASES
名称与别名
NUIGHKJGLOTHFS-FWIWLVIWSA-NGlu(OtBu)-Arg(Pmc)-Val-Asp(Allyl)-OBzlGlu(OtBu)-(L)Arg(Pmc)-Val-Asp(OAllyl)-OBzl
REACTIONS
参与反应
uspto-grants-2003_05 · 10.6084/m9.figshare.5104873.v1 · US06569993B1
查看