AIDS-123301

Molecular Formula: C57H72N10O12


InChI: InChI=1/C57H72N10O12/c1-34(68)49-56(77)66-31-39(58)29-47(66)54(75)59-24-6-9-45(60-51(72)38-13-15-40(16-14-38)64-25-27-65(28-26-64)41-17-21-44(22-18-41)79-33-37-7-4-3-5-8-37)52(73)62-50(35(2)69)57(78)67-32-43(71)30-48(67)55(76)61-46(53(74)63-49)23-12-36-10-19-42(70)20-11-36/h3-5,7-8,10-11,13-22,34-35,39,43,45-50,68-71H,6,9,12,23-33,58H2,1-2H3,(H,59,75)(H,60,72)(H,61,76)(H,62,73)(H,63,74)/t34?,35?,39-,43+,45-,46u,47u,48u,49?,50?/m0/s1/f/h59-63H

InChIKey: InChIKey=IZSQYJHDKUOYKS-GCGAXGCZDG
SMILES: CC(C1C(=O)N2CC(CC2C(=O)NC(C(=O)NC(C(=O)N3CC(CC3C(=O)NCCCC(C(=O)N1)NC(=O)C4=CC=C(C=C4)N5CCN(CC5)C6=CC=C(C=C6)OCC7=CC=CC=C7)N)C(C)O)CCC8=CC=C(C=C8)O)O)O

Names:
    AIDS-123301
    AIDS123301
    N-{(18S,26S,11R)-26-Amino-3,15-bis(hydroxyethyl)-11-hydroxy-6-[2-(4-hydroxyphenyl)ethyl]-2,5,8,14,17,23-hexaoxo-1,4,7,13,16,22-hexaazatricyclo[22.3.0.0<9,13>]heptacos-18-yl

Registries:
    PubChem CID 493697
    PubChem ID 219573