FAP targeting peptide for FXX489
HIT219250585
sdf文件结构编辑类似物检索
HIT ID: HIT219250585
Cas No: 3076328-74-7
分子式: C67H91N15O15
分子量: 1346.555
常用名: FAP targeting peptide for FXX489
常用名: FAP targeting peptide for FXX489
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-[(9S,12S,15S,18S,24S,27S,32aR)-12-{[4-(aminomethyl)phenyl]methyl}-9-benzyl-24-(4-{[4-(carboxymethyl)piperazine-1-carbonyl]amino}butyl)-15-hexyl-18-[(1H-indol-3-yl)methyl]-8-methyl-1,4,7,10,13,16,19,22,25,28-decaoxo-dotriacontahydropyrrolo[1,2-a]1,4,7,10,13,16,19,22,25,28-decaazacyclotriacontan-27-yl]acetic acid
IUPAC: 2-[(9S,12S,15S,18S,24S,27S,32aR)-12-{[4-(aminomethyl)phenyl]methyl}-9-benzyl-24-(4-{[4-(carboxymethyl)piperazine-1-carbonyl]amino}butyl)-15-hexyl-18-[(1H-indol-3-yl)methyl]-8-methyl-1,4,7,10,13,16,19,22,25,28-decaoxo-dotriacontahydropyrrolo[1,2-a]1,4,7,10,13,16,19,22,25,28-decaazacyclotriacontan-27-yl]acetic acid
SMILES: [H][C@]12CCCN1C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)N1CCN(CC(O)=O)CC1)NC(=O)CNC(=O)[C@H](Cc1c[nH]c3ccccc13)NC(=O)[C@H](CCCCCC)NC(=O)[C@H](Cc1ccc(CN)cc1)NC(=O)[C@H](Cc1ccccc1)N(C)C(=O)CNC(=O)CNC2=O
SMILES: [H][C@]12CCCN1C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCNC(=O)N1CCN(CC(O)=O)CC1)NC(=O)CNC(=O)[C@H](Cc1c[nH]c3ccccc13)NC(=O)[C@H](CCCCCC)NC(=O)[C@H](Cc1ccc(CN)cc1)NC(=O)[C@H](Cc1ccccc1)N(C)C(=O)CNC(=O)CNC2=O
InChI key: WBYPATMKRZTAQC-ZYWWURNJSA-N
共显示1个结果
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