Chemical Compound

(2S)-2-{[(2S)-1-[(10R,13S,16S,19S,22R)-19-(4-aminobutyl)-13-(carbamoylmethyl)-22-[(4-ethoxyphenyl)methyl]-12,15,18,21,24-pentaoxo-16-(propan-2-yl)-7,8-dithia-11,14,17,20,23-pentaazaspiro[5.19]pentacosane-10-carbonyl]pyrrolidin-2-yl]formamido}-5-carbamimidamido-N-[(1S)-1-carbamoyl-2-(4-hydroxyphenyl)ethyl]pentanamide

(2S)-2-{[(2S)-1-[(10R,13S,16S,19S,22R)-19-(4-aminobutyl)-13-(carbamoylmethyl)-22-[(4-ethoxyphenyl)methyl]-12,15,18,21,24-pentaoxo-16-(propan-2-yl)-7,8-dithia-11,14,17,20,23-pentaazaspiro[5.19]pentacosane-10-carbonyl]pyrrolidin-2-yl]formamido}-5-carbamimidamido-N-[(1S)-1-carbamoyl-2-(4-hydroxyphenyl)ethyl]pentanamide 结构式
Primary record

(2S)-2-{[(2S)-1-[(10R,13S,16S,19S,22R)-19-(4-aminobutyl)-13-(carbamoylmethyl)-22-[(4-ethoxyphenyl)methyl]-12,15,18,21,24-pentaoxo-16-(propan-2-yl)-7,8-dithia-11,14,17,20,23-pentaazaspiro[5.19]pentacosane-10-carbonyl]pyrrolidin-2-yl]formamido}-5-carbamimidamido-N-[(1S)-1-carbamoyl-2-(4-hydroxyphenyl)ethyl]pentanamide

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177397543
SMILES
CCOC1=CC=C(C=C1)CC2C(=O)NC(C(=O)N[C@H](C(=O)N[C@H](C(=O)NC(CSSC3(CCCCC3)CC(=O)N2)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC5=CC=C(C=C5)O)C(=O)N)CC(=O)N)C(C)C)CCCCN
Canonical SMILES
CCOc1ccc(CC2NC(=O)CC3(CCCCC3)SSCC(C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc3ccc(O)cc3)C(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)C(CCCCN)NC2=O)cc1

名称与同义词

  • J1.007.357J
  • (2S)-2-{[(2S)-1-[(10R,13S,16S,19S,22R)-19-(4-aminobutyl)-13-(carbamoylmethyl)-22-[(4-ethoxyphenyl)methyl]-12,15,18,21,24-pentaoxo-16-(propan-2-yl)-7,8-dithia-11,14,17,20,23-pentaazaspiro[5.19]pentacosane-10-carbonyl]pyrrolidin-2-yl]formamido}-5-carbamimidamido-N-[(1S)-1-carbamoyl-2-(4-hydroxyphenyl)ethyl]pentanamide
  • N-[[1-Mercapto(1)-cyclohexyl]acetyl]-O-ethyl-D-Tyr-L-Lys-L-Val-L-Asn-L-Cys(1)-L-Pro-L-Arg-L-Tyr-NH2