Products 3093661-13-0
CAS 3093661-13-0 is the registry number for Conofurin-Delta. Offered by: MedChemExpress. Available pack sizes: Get quote.
(1R,6R,9S,12S,15S,18S,21S,24S,27S,30R,33S,36S,42S,45S,50R)-50-[(2-aminoacetyl)amino]-12,18,21,24-tetrakis(3-carbamimidamidopropyl)-9,27,45-tris(hydroxymethyl)-42-(1H-imidazol-5-ylmethyl)-15,33-dimethyl-8,11,14,17,20,23,26,29,32,35,41,44,47,49-tetradecaoxo-3,4,52,53-tetrathia-7,10,13,16,19,22,25,28,31,34,40,43,46,48-tetradecazatricyclo[28.17.7.036,40]tetrapentacontane-6-carboxamide (CAS 3093661-13-0) is a chemical compound with the molecular formula C64H109N31O19S4 and a molecular weight of 1745.0 g/mol. IUPAC name: (1R,6R,9S,12S,15S,18S,21S,24S,27S,30R,33S,36S,42S,45S,50R)-50-[(2-aminoacetyl)amino]-12,18,21,24-tetrakis(3-carbamimidamidopropyl)-9,27,45-tris(hydroxymethyl)-42-(1H-imidazol-5-ylmethyl)-15,33-dimethyl-8,11,14,17,20,23,26,29,32,35,41,44,47,49-tetradecaoxo-3,4,52,53-tetrathia-7,10,13,16,19,22,25,28,31,34,40,43,46,48-tetradecazatricyclo[28.17.7.036,40]tetrapentacontane-6-carboxamide. InChIKey: SQSAMEHYKFOBLN-DQNYIQSGSA-N.
| Molecular formula | C64H109N31O19S4 |
|---|---|
| Molecular weight | 1745.0 g/mol |
| IUPAC name | (1R,6R,9S,12S,15S,18S,21S,24S,27S,30R,33S,36S,42S,45S,50R)-50-[(2-aminoacetyl)amino]-12,18,21,24-tetrakis(3-carbamimidamidopropyl)-9,27,45-tris(hydroxymethyl)-42-(1H-imidazol-5-ylmethyl)-15,33-dimethyl-8,11,14,17,20,23,26,29,32,35,41,44,47,49-tetradecaoxo-3,4,52,53-tetrathia-7,10,13,16,19,22,25,28,31,34,40,43,46,48-tetradecazatricyclo[28.17.7.036,40]tetrapentacontane-6-carboxamide |
| InChIKey | SQSAMEHYKFOBLN-DQNYIQSGSA-N |
| SMILES | C[C@H]1C(=O)N[C@H]2CSSC[C@@H](C(=O)N[C@@H](CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC2=O)CO)CCCNC(=N)N)CCCNC(=N)N)CCCNC(=N)N)C)CCCNC(=N)N)CO)C(=O)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N3CCC[C@H]3C(=O)N1)CC4=CN=CN4)CO)NC(=O)CN |
Computed by PubChem (NCBI)
Synonyms:
orb3180594