HIT ID: HIT218847915
Cas No: 135662-04-3
分子式: C46H65N13O12
分子量: 992.105
常用名: DNP-Pro-Leu-Ala-Leu-Trp-Ala-Arg-OH
常用名: DNP-Pro-Leu-Ala-Leu-Trp-Ala-Arg-OH
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2S)-5-carbamimidamido-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-{[(2S)-1-(2,4-dinitrophenyl)pyrrolidin-2-yl]formamido}-4-methylpentanamido]propanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]propanamido]pentanoic acid
IUPAC: (2S)-5-carbamimidamido-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-{[(2S)-1-(2,4-dinitrophenyl)pyrrolidin-2-yl]formamido}-4-methylpentanamido]propanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]propanamido]pentanoic acid
SMILES: CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1c1ccc(cc1[N+]([O-])=O)[N+]([O-])=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
SMILES: CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1c1ccc(cc1[N+]([O-])=O)[N+]([O-])=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
InChI key: ZOYUSWUFUJNFBR-KDKQPVBBSA-N
