Chemical Compound

Echinomycin

CAS Registry Number 512-64-1
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
23724556
SMILES
CC1C(=O)N(C2CSC(C(C(=O)N(C(C(=O)OC[C@H](C(=O)N1)NC(=O)C3=NC4=CC=CC=C4N=C3)C(C)C)C)N(C(=O)C(NC(=O)[C@@H](COC(=O)C(N(C2=O)C)C(C)C)NC(=O)C5=NC6=CC=CC=C6N=C5)C)C)SC)C
Canonical SMILES
CSC1SCC2C(=O)N(C)C(C(C)C)C(=O)OC[C@@H](NC(=O)c3cnc4ccccc4n3)C(=O)NC(C)C(=O)N(C)C1C(=O)N(C)C(C(C)C)C(=O)OC[C@@H](NC(=O)c1cnc3ccccc3n1)C(=O)NC(C)C(=O)N2C

Names & Synonyms

  • Echinomycin
  • Quinomycin A
  • S-426-S (Lepetit)
  • UNII-TG824J6RQT
  • CHEBI:80052
  • SK 302B
  • C51H64N12O12S2
  • NSC526417
  • NSC 526417
  • NSC-526417
  • BRN 0078671
  • PD118071
  • C51-H64-N12-O12-S2
  • C15722
  • 4-27-00-09726 (Beilstein Handbook Reference)
  • Q27149203
  • 512-64-1
  • N-[(7R,20R)-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
  • 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)