HIT ID: HIT214320868
Cas No: 1325307-57-0
分子式: C34H47N9O11
分子量: 757.802
常用名: Bz-IEGR-pNA (acetate)
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (4S)-4-[({[(1S)-4-carbamimidamido-1-[(4-nitrophenyl)carbamoyl]butyl]carbamoyl}methyl)carbamoyl]-4-[(2S,3S)-3-methyl-2-(phenylformamido)pentanamido]butanoic acid; acetic acid
IUPAC: (4S)-4-[({[(1S)-4-carbamimidamido-1-[(4-nitrophenyl)carbamoyl]butyl]carbamoyl}methyl)carbamoyl]-4-[(2S,3S)-3-methyl-2-(phenylformamido)pentanamido]butanoic acid; acetic acid
SMILES: CC(O)=O.CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)Nc1ccc(cc1)N(=O)=O
SMILES: CC(O)=O.CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)Nc1ccc(cc1)N(=O)=O
InChI key: ITXQNZUGLZNGBM-PJSBSAQXSA-N
