Name: VKGILS-NH2 Acetate
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT213840628
Cas No:2763585-10-8
常用名:VKGILS-NH2 Acetate
别名:VKGILS-NH2 Acetate (942413-05-0 Free base)
别名:VKGILS-NH2 Acetate (942413-05-0 Free base)
IUPAC:(2S)-6-amino-2-[(2S)-2-amino-3-methylbutanamido]-N-({[(1S,2S)-1-{[(1S)-1-{[(1S)-1-carbamoyl-2-hydroxyethyl]carbamoyl}-3-methylbutyl]carbamoyl}-2-methylbutyl]carbamoyl}methyl)hexanamide; acetic acid
IUPAC:(2S)-6-amino-2-[(2S)-2-amino-3-methylbutanamido]-N-({[(1S,2S)-1-{[(1S)-1-{[(1S)-1-carbamoyl-2-hydroxyethyl]carbamoyl}-3-methylbutyl]carbamoyl}-2-methylbutyl]carbamoyl}methyl)hexanamide; acetic acid
InChI key:RIVOYAFXFOAVGG-HZIHITNPSA-N

分子式:C30H58N8O9
分子量:674.841
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(O)=O.CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(N)=O
SMILES:CC(O)=O.CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(N)=O

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