Chemical Compound

Echinomycin

CAS Registry Number 512-64-1
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Echinomycin chemical structure
Primary Record

Echinomycin

In stock
4,363 g
Purity
98.7 %
CAS
512-64-1

Compound Identifiers & Properties

CAS
512-64-1
PubChem CID
458034
SMILES
C[C@@H]1C(=O)N([C@H]2CSC([C@@H](C(=O)N([C@H](C(=O)OC[C@H](C(=O)N1)NC(=O)C3=NC4=CC=CC=C4N=C3)C(C)C)C)N(C(=O)[C@H](NC(=O)[C@@H](COC(=O)[C@@H](N(C2=O)C)C(C)C)NC(=O)C5=NC6=CC=CC=C6N=C5)C)C)SC)C
Canonical SMILES
CSC1SC[C@H]2C(=O)N(C)[C@@H](C(C)C)C(=O)OC[C@@H](NC(=O)c3cnc4ccccc4n3)C(=O)N[C@H](C)C(=O)N(C)[C@@H]1C(=O)N(C)[C@@H](C(C)C)C(=O)OC[C@@H](NC(=O)c1cnc3ccccc3n1)C(=O)N[C@H](C)C(=O)N2C

Names & Synonyms

  • Echinomycin
  • Quinomycin A
  • Levomycin
  • Echinomycin A
  • S-426-S (Lepetit)
  • UNII-TG824J6RQT
  • AC1L9XN9
  • SK 302B
  • NSC526417
  • C51H64N12O12S2
  • CID458034
  • NSC 526417
  • NSC-526417
  • BRN 0078671
  • C51-H64-N12-O12-S2
  • 4-27-00-09726 (Beilstein Handbook Reference)
  • 512-64-1
  • N-[(1R,4R,7R,11S,14R,17R,20R,24S)-2,4,12,15,17,25-Hexamethyl-27-methylsulfanyl-3,6,10,13,16,19,23,26-octaoxo-11,24-di(propan-2-yl)-20-(quinoxaline-2-carbonylamino)-9,22-dioxa-28-thia-2,5,12,15,18,25-hexazabicyclo[12.12.3]nonacosan-7-yl]quinoxaline-2-carboxamide
  • N-[(11S,24S,1R,4R,7R,14R,17R,20R)-2,5,12,15,18,25-hexaaza-11,24-bis(methylethyl)-2,4,12,15,17,25-hexamethyl-27-methylthio-9,22-dioxa-3,6,10,13,16,19,23,26-octaoxo-20-(quinoxalin-2-ylcarbonylamino)-28-thiabicyclo[12.12.3]nonacos-7-yl]quinoxalin-2-ylcarboxamide
  • N-[(1R,4R,7R,11S,14R,17R,20R,24S)-11,24-diisopropyl-2,4,12,15,17,25-hexamethyl-29-methylsulfanyl-3,6,10,13,16,19,23,26-octaoxo-7-(quinoxaline-2-carbonylamino)-9,22-dioxa-28-thia-2,5,12,15,18,25-hexazabicyclo[12.12.3]nonacosan-20-yl]quinoxaline-2-carboxamide
  • N-[(1R,4R,7R,11S,14R,17R,20R,24S)-2,4,12,15,17,25-hexamethyl-29-methylsulfanyl-3,6,10,13,16,19,23,26-octaoxo-11,24-di(propan-2-yl)-7-(quinoxaline-2-carbonylamino)-9,22-dioxa-28-thia-2,5,12,15,18,25-hexazabicyclo[12.12.3]nonacosan-20-yl]quinoxaline-2-carboxamide
  • Stereoisomer of N,N'-(2,4,12,15,17,25-hexamethyl-11,24-bis(1-methylethyl)-27-(methylthio)-3,6,10,13,16,19,23,26-octaoxo-9,22-dioxa-28-thia-2,5,12,15,18,25-hexaazabicyclo(12.12.3)nonacosane-7,20-diyl)bis(2-quinoxalinecarboxamide)