C51H64N12O12S2
1101.3 g/mol
APIDanger
Echinomycin
CAS512-64-1EC637-095-9
Category
API
Compound Class
Peptide
Primary Use
Pharmaceutical Raw Material
Echinomycin is a peptide antibiotic with a cyclic dimer structure, featuring a bicyclic aromatic chromophore and a thioacetal bridge. It is a cytotoxic quinoxaline antineoplastic antibiotic used primarily as a pharmaceutical raw material in cancer research.
pharmaceutical raw material for antineoplastic researchlaboratory reagent in cancer mechanism studies
Content scope: Information here supports chemical identification and industrial supply, research, and manufacturing contexts. It is not a therapeutic claim, medical advice, or drug-use instructions.
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CAS 512-64-1
Related Compounds
Safety Reference
Danger
H301Toxic if swallowed
H311Toxic in contact with skin
H331Toxic if inhaled
H361Suspected of damaging fertility or the unborn child
Identifiers
IUPAC Name
N-[(1R,4S,7R,11S,14R,17S,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
InChIKey
AUJXLBOHYWTPFV-VITLIGDRSA-N
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
Synonyms (16)
- ANTIBIOTIC A-654I
- Bis-Quinoline Analogue
- Echinomycin
- Echinomycin A
- Quinomycin A
- S-426-S (Lepetit)
- SK 302B