Name: Tyr-(D-Dab4,Arg5,D-Trp8)-cyclo-Somatostatin-14 (4-11)
Rating: 5 (10 reviews)

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结构编辑

类似物检索

HIT ID:HIT218851622
Cas No:496849-46-8
常用名:Tyr-(D-Dab4,Arg5,D-Trp8)-cyclo-Somatostatin-14 (4-11)
常用名:Tyr-(D-Dab4,Arg5,D-Trp8)-cyclo-Somatostatin-14 (4-11)
IUPAC:(2S)-2-amino-N-[(3S,6S,9S,12R,15S,18S,21S,24R)-9-(4-aminobutyl)-3,15,18-tribenzyl-21-(3-carbamimidamidopropyl)-6-[(1R)-1-hydroxyethyl]-12-[(1H-indol-3-yl)methyl]-2,5,8,11,14,17,20,23-octaoxo-1,4,7,10,13,16,19,22-octaazacyclohexacosan-24-yl]-3-(4-hydroxyphenyl)propanamide
IUPAC:(2S)-2-amino-N-[(3S,6S,9S,12R,15S,18S,21S,24R)-9-(4-aminobutyl)-3,15,18-tribenzyl-21-(3-carbamimidamidopropyl)-6-[(1R)-1-hydroxyethyl]-12-[(1H-indol-3-yl)methyl]-2,5,8,11,14,17,20,23-octaoxo-1,4,7,10,13,16,19,22-octaazacyclohexacosan-24-yl]-3-(4-hydroxyphenyl)propanamide
InChI key:XRRYCKNEBSTWIE-PPRXGWNGSA-N

分子式:C67H85N15O11
分子量:1276.511
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]1(NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](CCNC(=O)[C@H](Cc2ccccc2)NC1=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O
SMILES:[H][C@]1(NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](CCNC(=O)[C@H](Cc2ccccc2)NC1=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O

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