ZIP
HIT217629962
sdf文件结构编辑类似物检索
HIT ID: HIT217629962
Cas No: 863987-12-6
分子式: C90H154N30O17
分子量: 1928.415
常用名: ZIP
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2S)-2-[(2S)-6-amino-2-[(2S)-5-carbamimidamido-2-[(2S)-2-[(2S)-5-carbamimidamido-2-[(2S)-5-carbamimidamido-2-[(2S)-2-{2-[(2S)-5-carbamimidamido-2-[(2S)-5-carbamimidamido-2-[(2S)-2-[(2S,3S)-2-[(2S)-3-hydroxy-2-tetradecanamidopropanamido]-3-methylpentanamido]-3-(4-hydroxyphenyl)propanamido]pentanamido]pentanamido]acetamido}propanamido]pentanamido]pentanamido]-3-(1H-indol-3-yl)propanamido]pentanamido]hexanamido]-4-methylpentanoic acid
IUPAC: (2S)-2-[(2S)-6-amino-2-[(2S)-5-carbamimidamido-2-[(2S)-2-[(2S)-5-carbamimidamido-2-[(2S)-5-carbamimidamido-2-[(2S)-2-{2-[(2S)-5-carbamimidamido-2-[(2S)-5-carbamimidamido-2-[(2S)-2-[(2S,3S)-2-[(2S)-3-hydroxy-2-tetradecanamidopropanamido]-3-methylpentanamido]-3-(4-hydroxyphenyl)propanamido]pentanamido]pentanamido]acetamido}propanamido]pentanamido]pentanamido]-3-(1H-indol-3-yl)propanamido]pentanamido]hexanamido]-4-methylpentanoic acid
SMILES: CCCCCCCCCCCCCC(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(O)=O
SMILES: CCCCCCCCCCCCCC(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(O)=O
InChI key: CRKARHQCXWSUMV-HOHDCHNJSA-N
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