Produkty 2549046-46-8
CAS 2549046-46-8 to numer rejestracyjny substancji KS-58. Oferty producentów: MedChemExpress. Dostępne opakowania: Get quote.
2-[(1S,4S,7S,13S,16S,19S,22S,25R,28S,31S)-28-butyl-16-[(4-fluorophenyl)methyl]-22-heptyl-19-(hydroxymethyl)-4-(1H-indol-3-ylmethyl)-3,6,12,15,18,21,24,27,30,36,40-undecaoxo-42,46-dithia-2,5,11,14,17,20,23,26,29,35,39-undecazatetracyclo[23.15.7.07,11.031,35]heptatetracontan-13-yl]acetic acid (CAS 2549046-46-8) to związek chemiczny o wzorze sumarycznym C64H89FN12O14S2 i masie molowej 1333.6 g/mol. Nazwa systematyczna IUPAC: 2-[(1S,4S,7S,13S,16S,19S,22S,25R,28S,31S)-28-butyl-16-[(4-fluorophenyl)methyl]-22-heptyl-19-(hydroxymethyl)-4-(1H-indol-3-ylmethyl)-3,6,12,15,18,21,24,27,30,36,40-undecaoxo-42,46-dithia-2,5,11,14,17,20,23,26,29,35,39-undecazatetracyclo[23.15.7.07,11.031,35]heptatetracontan-13-yl]acetic acid. InChIKey: GMYHLYYDPRAGER-KHWZEQBASA-N.
| Wzór sumaryczny | C64H89FN12O14S2 |
|---|---|
| Masa molowa | 1333.6 g/mol |
| Nazwa IUPAC | 2-[(1S,4S,7S,13S,16S,19S,22S,25R,28S,31S)-28-butyl-16-[(4-fluorophenyl)methyl]-22-heptyl-19-(hydroxymethyl)-4-(1H-indol-3-ylmethyl)-3,6,12,15,18,21,24,27,30,36,40-undecaoxo-42,46-dithia-2,5,11,14,17,20,23,26,29,35,39-undecazatetracyclo[23.15.7.07,11.031,35]heptatetracontan-13-yl]acetic acid |
| InChIKey | GMYHLYYDPRAGER-KHWZEQBASA-N |
| SMILES | CCCCCCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@@H]3CSCCCSC[C@@H](C(=O)N1)NC(=O)[C@@H](NC(=O)[C@@H]4CCCN4C(=O)CCNC3=O)CCCC)CC5=CNC6=CC=CC=C65)CC(=O)O)CC7=CC=C(C=C7)F)CO |
Dane obliczone przez PubChem (NCBI)
Synonimy:
orb2813708