Chemical Compound

(2S)-2-[[(4R,7S,10S,13S,16R,19S,22S,25R)-7,10-bis(4-aminobutyl)-13-(3-amino-3-oxopropyl)-25-[[(2S)-2-amino-3-phenylpropanoyl]amino]-22-[(1R)-1-hydroxyethyl]-16-(hydroxymethyl)-19-methyl-6,9,12,15,18,21,24-heptaoxo-1,2-dithia-5,8,11,14,17,20,23-heptazacyclohexacosane-4-carbonyl]amino]-3-(4-hydroxyphenyl)propanoic acid

CAS Registry Number 187826-35-3
(2S)-2-[[(4R,7S,10S,13S,16R,19S,22S,25R)-7,10-bis(4-aminobutyl)-13-(3-amino-3-oxopropyl)-25-[[(2S)-2-amino-3-phenylpropanoyl]amino]-22-[(1R)-1-hydroxyethyl]-16-(hydroxymethyl)-19-methyl-6,9,12,15,18,21,24-heptaoxo-1,2-dithia-5,8,11,14,17,20,23-heptazacyclohexacosane-4-carbonyl]amino]-3-(4-hydroxyphenyl)propanoic acid 结构式
Primary record

(2S)-2-[[(4R,7S,10S,13S,16R,19S,22S,25R)-7,10-bis(4-aminobutyl)-13-(3-amino-3-oxopropyl)-25-[[(2S)-2-amino-3-phenylpropanoyl]amino]-22-[(1R)-1-hydroxyethyl]-16-(hydroxymethyl)-19-methyl-6,9,12,15,18,21,24-heptaoxo-1,2-dithia-5,8,11,14,17,20,23-heptazacyclohexacosane-4-carbonyl]amino]-3-(4-hydroxyphenyl)propanoic acid

库存
6,067 克
纯度
99.0 %
CAS
187826-35-3

化合物标识与属性

CAS
187826-35-3
PubChem CID
474053
SMILES
C[C@H]1C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N1)[C@@H](C)O)NC(=O)[C@H](CC2=CC=CC=C2)N)C(=O)N[C@@H](CC3=CC=C(C=C3)O)C(=O)O)CCCCN)CCCCN)CCC(=O)N)CO
Canonical SMILES
C[C@@H]1NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccccc2)CSSC[C@@H](C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CO)NC1=O

名称与同义词

  • AC1LAS5X
  • CDR1.AME(17-22)
  • DTXSID00172094
  • AIDS081661
  • CID474053
  • FCTASQKKCY (Cyclized/Cysteine-oxidized)
  • 187826-35-3
  • (2S)-2-[[(4R,7S,10S,13S,16R,19S,22S,25R)-7,10-bis(4-aminobutyl)-13-(3-amino-3-oxopropyl)-25-[[(2S)-2-amino-3-phenylpropanoyl]amino]-22-[(1R)-1-hydroxyethyl]-16-(hydroxymethyl)-19-methyl-6,9,12,15,18,21,24-heptaoxo-1,2-dithia-5,8,11,14,17,20,23-heptazacyclohexacosane-4-carbonyl]amino]-3-(4-hydroxyphenyl)propanoic acid
  • L-Tyrosine, L-phenylalanyl-L-cysteinyl-L-threonyl-L-alanyl-L-seryl-L-glutaminyl-L-lysyl-L-lysyl-L-cysteinyl-, cyclic (2==>9)-disulfide
  • N-[(4R,7S,10S,13S,16R,19S,22S,25R)-7,10-Bis(4-aminobutyl)-13-(3-amino-3-oxopropyl)-22-[(1R)-1-hydroxyethyl]-16-(hydroxymethyl)-19-methyl-6,9,12,15,18,21,24-heptaoxo-25-(L-phenylalanylamino)-1,2-dithia-5,8,11,14,17,20,23-heptaazacyclohexacosane-4-carbonyl]-L-tyrosine