CAS: 11001-74-4 - L-Alloisoleucine, N-(2-quinoxalinylcarbonyl)-O-[N-(2-quinoxalinylcarbonyl)-D-seryl-L-alanyl-3-mercapto-N,S-dimethylcysteinyl-N,4-dimethyl-L-alloisoleucyl]-D-seryl-L-alanyl-N-methylcysteinyl-N,4-dimethyl-, (8→1)-lactone, cyclic (3→7)-thioether

Formula:C₅₅H₇₂N₁₂O₁₂S₂

InChI:InChI=1S/C55H72N12O12S2/c1-27(2)29(5)42-53(76)78-24-40(63-46(69)38-23-57-34-19-15-17-21-36(34)61-38)48(71)59-32(8)50(73)67(12)44-52(75)66(11)43(30(6)28(3)4)54(77)79-25-39(62-45(68)37-22-56-33-18-14-16-20-35(33)60-37)47(70)58-31(7)49(72)64(9)41(51(74)65(42)10)26-81-55(44)80-13/h14-23,27-32,39-44,55H,24-26H2,1-13H3,(H,58,70)(H,59,71)(H,62,68)(H,63,69)

InChI key:InChIKey=WNYOPINACXXCOV-UHFFFAOYSA-N

SMILES:O=C(NC1C(=O)NC(C(=O)N(C)C2C(=O)N(C)C(C(=O)OCC(NC(=O)C3=NC4=CC=CC=C4N=C3)C(=O)NC(C(=O)N(C)C(C(=O)N(C)C(C(=O)OC1)C(C)C(C)C)C(SC)SC2)C)C(C)C(C)C)C)C5=NC6=CC=CC=C6N=C5

Synonyms:
9,22-Dioxa-28-thia-2,5,12,15,18,25-hexaazabicyclo[12.12.3]nonacosane, cyclic peptide deriv.
Quinomycin C
Antibiotic U 48160
L-Alloisoleucine, N-(2-quinoxalinylcarbonyl)-O-[N-(2-quinoxalinylcarbonyl)-D-seryl-L-alanyl-3-mercapto-N,S-dimethylcysteinyl-N,4-dimethyl-L-alloisoleucyl]-D-seryl-L-alanyl-N-methylcysteinyl-N,4-dimethyl-, (8→1)-lactone, cyclic (3→7)-thioether
Quinomycin A, 4-(N,4-dimethyl-L-alloisoleucine)-8-(N,4-dimethyl-L-alloisoleucine)-