HIT ID: HIT214319010
Cas No: 16870-37-4
分子式: C35H46N6O8S
分子量: 710.85
常用名: Amogastrin
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (3S)-3-{[(1S)-1-carbamoyl-2-phenylethyl]carbamoyl}-3-[(2S)-2-[(2S)-3-(1H-indol-3-yl)-2-({[(2-methylbutan-2-yl)oxy]carbonyl}amino)propanamido]-4-(methylsulfanyl)butanamido]propanoic acid
IUPAC: (3S)-3-{[(1S)-1-carbamoyl-2-phenylethyl]carbamoyl}-3-[(2S)-2-[(2S)-3-(1H-indol-3-yl)-2-({[(2-methylbutan-2-yl)oxy]carbonyl}amino)propanamido]-4-(methylsulfanyl)butanamido]propanoic acid
SMILES: CCC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
SMILES: CCC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
InChI key: CAVZBWFUMSXZFB-LJWNLINESA-N
