Chemical Compound

(S)-2-(2-((S)-2-((S)-1-((4S,7S,10S,13S)-7-allyl-17-amino-10-sec-butyl-4-(2-(methylthio)ethyl)-2,5,8,11-tetraoxo-3,6,9,12-tetraazaheptadecanecarbonyl)pyrrolidine-2-carboxamido)-3-(1H-imidazol-5-yl)propanamido)acetamido)-N1-((S)-1-((2S,3S)-1-amino-3-methyl-1-oxopentan-2-ylamino)-1-oxopent-4-en-2-yl)pentanediamide

(S)-2-(2-((S)-2-((S)-1-((4S,7S,10S,13S)-7-allyl-17-amino-10-sec-butyl-4-(2-(methylthio)ethyl)-2,5,8,11-tetraoxo-3,6,9,12-tetraazaheptadecanecarbonyl)pyrrolidine-2-carboxamido)-3-(1H-imidazol-5-yl)propanamido)acetamido)-N1-((S)-1-((2S,3S)-1-amino-3-methyl-1-oxopentan-2-ylamino)-1-oxopent-4-en-2-yl)pentanediamide 结构式
Primary record

(S)-2-(2-((S)-2-((S)-1-((4S,7S,10S,13S)-7-allyl-17-amino-10-sec-butyl-4-(2-(methylthio)ethyl)-2,5,8,11-tetraoxo-3,6,9,12-tetraazaheptadecanecarbonyl)pyrrolidine-2-carboxamido)-3-(1H-imidazol-5-yl)propanamido)acetamido)-N1-((S)-1-((2S,3S)-1-amino-3-methyl-1-oxopentan-2-ylamino)-1-oxopent-4-en-2-yl)pentanediamide

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
53325256
SMILES
CC[C@H](C)[C@@H](C(=O)N)NC(=O)[C@H](CC=C)NC(=O)[C@H](CCC(=O)N)NC(=O)CNC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CC=C)NC(=O)[C@H](CCSC)NC(=O)C
Canonical SMILES
C=CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC=C)NC(=O)[C@H](CCSC)NC(C)=O)[C@@H](C)CC)C(=O)N[C@H](C(N)=O)[C@@H](C)CC

名称与同义词

  • CHEMBL1684370
  • BDBM50338751
  • (S)-2-(2-((S)-2-((S)-1-((4S,7S,10S,13S)-7-allyl-17-amino-10-sec-butyl-4-(2-(methylthio)ethyl)-2,5,8,11-tetraoxo-3,6,9,12-tetraazaheptadecanecarbonyl)pyrrolidine-2-carboxamido)-3-(1H-imidazol-5-yl)propanamido)acetamido)-N1-((S)-1-((2S,3S)-1-amino-3-methyl-1-oxopentan-2-ylamino)-1-oxopent-4-en-2-yl)pentanediamide