HIT ID: HIT213840131
Cas No: TP1250L
分子式: C40H67N9O11
分子量: 850.028
常用名: Acetyl-PHF6 amide acetate
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2S)-N-[(1S,2S)-1-{[(1S)-1-{[(1S)-1-{[(1S)-5-amino-1-carbamoylpentyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-methylpropyl]carbamoyl}-2-methylbutyl]-2-[(2S)-2-acetamido-3-methylbutanamido]pentanediamide; acetic acid
IUPAC: (2S)-N-[(1S,2S)-1-{[(1S)-1-{[(1S)-1-{[(1S)-5-amino-1-carbamoylpentyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-methylpropyl]carbamoyl}-2-methylbutyl]-2-[(2S)-2-acetamido-3-methylbutanamido]pentanediamide; acetic acid
SMILES: CC(O)=O.CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(C)=O)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(N)=O
SMILES: CC(O)=O.CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(C)=O)C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(N)=O
InChI key: JXHRFWFVWJRTGW-YNUHNEFWSA-N
