Chemical Compound

Aeruginopeptin 228-A

CAS Registry Number 152510-33-3
Aeruginopeptin 228-A chemical structure
Primary Record

Aeruginopeptin 228-A

In stock
2,076 g
Purity
98.6 %
CAS
152510-33-3

Compound Identifiers & Properties

CAS
152510-33-3
PubChem CID
139584653
SMILES
CC[C@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)NC2CCC(N(C2=O)[C@H](C(=O)N([C@H](C(=O)N1)CC3=CC=CC=C3)C)[C@@H](C)O)O)CC4=CC=C(C=C4)O)NC(=O)[C@H](CCC(=O)N)NC(=O)C(CC5=CC=C(C=C5)O)O)C
Canonical SMILES
CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H]([C@@H](C)O)N2C(=O)C(CCC2O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)C(O)Cc2ccc(O)cc2)[C@@H](C)OC1=O

Names & Synonyms

  • Aeruginopeptin 228-A
  • RefChem:109884
  • CHEBI:202752
  • (2S)-N-[(2S,5S,8S,11R,12S,15S)-5-benzyl-8-[(2S)-butan-2-yl]-21-hydroxy-2-[(1R)-1-hydroxyethyl]-15-[(4-hydroxyphenyl)methyl]-4,11-dimethyl-3,6,9,13,16,22-hexaoxo-10-oxa-1,4,7,14,17-pentazabicyclo[16.3.1]docosan-12-yl]-2-[[2-hydroxy-3-(4-hydroxyphenyl)propanoyl]amino]pentanediamide
  • (2R)-N-((2S,5S,8S,11R,12S,15S,18S,21R)-5-Benzyl-8-((2S)-butan-2-yl)-6,13,16,21-tetrahydroxy-2-((1R)-1-hydroxyethyl)-15-((4-hydroxyphenyl)methyl)-4,11-dimethyl-3,9,22-trioxo-10-oxa-1,4,7,14,17-pentaazabicyclo(16.3.1)docosa-6,13,16-trien-12-yl)-2-(((2R)-1,2-dihydroxy-3-(4-hydroxyphenyl)propylidene)amino)pentanediimidate
  • (2R)-N-[(2S,5S,8S,11R,12S,15S,18S,21R)-5-Benzyl-8-[(2S)-butan-2-yl]-6,13,16,21-tetrahydroxy-2-[(1R)-1-hydroxyethyl]-15-[(4-hydroxyphenyl)methyl]-4,11-dimethyl-3,9,22-trioxo-10-oxa-1,4,7,14,17-pentaazabicyclo[16.3.1]docosa-6,13,16-trien-12-yl]-2-{[(2R)-1,2-dihydroxy-3-(4-hydroxyphenyl)propylidene]amino}pentanediimidate
  • (2S)-N-((2S,5S,8S,11R,12S,15S)-5-benzyl-8-((2S)-butan-2-yl)-21-hydroxy-2-((1R)-1-hydroxyethyl)-15-((4-hydroxyphenyl)methyl)-4,11-dimethyl-3,6,9,13,16,22-hexaoxo-10-oxa-1,4,7,14,17-pentazabicyclo(16.3.1)docosan-12-yl)-2-((2-hydroxy-3-(4-hydroxyphenyl)propanoyl)amino)pentanediamide
  • 152510-33-3