HIT ID: HIT212716184
Cas No: 137182-25-3
分子式: C32H43N7O8
分子量: 653.737
常用名: Fulicin
氢键受体数 (HBA): 9
氢键供体数 (HBD): 8
LogP: -3.3999326
IUPAC: (4S)-4-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-carbamoylpropanamido]-4-{[(1S)-1-{[(1S)-1-carbamoyl-2-methylpropyl]carbamoyl}-2-phenylethyl]carbamoyl}butanoic acid
IUPAC: (4S)-4-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-carbamoylpropanamido]-4-{[(1S)-1-{[(1S)-1-carbamoyl-2-methylpropyl]carbamoyl}-2-phenylethyl]carbamoyl}butanoic acid
SMILES: CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)C(N)=O
SMILES: CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)C(N)=O
InChI key: NNCPNXNWAQSRCG-CPASSRBFSA-N
