Chemical Compound

(2S,3R)-2-{[(4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-7-ethyl-19-[(2R)-2-{2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamido}-3-phenylpropanamido]-16-[(4-hydroxyphenyl)methyl]-13-[(1H-indol-3-yl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]formamido}-3-hydroxybutanamide

CAS Registry Number 182153-96-4
返回搜索 申请报价
(2S,3R)-2-{[(4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-7-ethyl-19-[(2R)-2-{2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamido}-3-phenylpropanamido]-16-[(4-hydroxyphenyl)methyl]-13-[(1H-indol-3-yl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]formamido}-3-hydroxybutanamide 结构式
Primary record

(2S,3R)-2-{[(4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-7-ethyl-19-[(2R)-2-{2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamido}-3-phenylpropanamido]-16-[(4-hydroxyphenyl)methyl]-13-[(1H-indol-3-yl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]formamido}-3-hydroxybutanamide

库存
4,234 克
纯度
99.3 %
CAS
182153-96-4

化合物标识与属性

CAS
182153-96-4
PubChem CID
171360550
SMILES
CCC1C(=O)NC(CSSCC(C(=O)N[C@H](C(=O)NC(C(=O)N[C@H](C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=C(C=C4)O)NC(=O)[C@@H](CC5=CC=CC=C5)NC(=O)CN6CCN(CC6)CCO)C(=O)N[C@@H]([C@@H](C)O)C(=O)N
Canonical SMILES
CCC1NC(=O)[C@H](CCCCN)NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)C(NC(=O)[C@@H](Cc2ccccc2)NC(=O)CN2CCN(CCO)CC2)CSSCC(C(=O)N[C@H](C(N)=O)[C@@H](C)O)NC1=O

名称与同义词

  • BIM-23190
  • J945.854I
  • (2S,3R)-2-{[(4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-7-ethyl-19-[(2R)-2-{2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamido}-3-phenylpropanamido]-16-[(4-hydroxyphenyl)methyl]-13-[(1H-indol-3-yl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]formamido}-3-hydroxybutanamide
  • 182153-96-4
  • N-[[4-(2-Hydroxyethyl)-1-piperazinyl]acetyl]-D-Phe-L-Cys(1)-L-Tyr-D-Trp-L-Lys-L-Abu-L-Cys(1)-L-Thr-NH2