AIDS-123255

Molecular Formula: C57H71N7O12


InChI: InChI=1/C57H71N7O12/c1-4-5-6-31-76-44-26-22-40(23-27-44)38-16-14-37(15-17-38)39-18-20-41(21-19-39)51(69)59-45-9-7-29-58-54(72)47-10-8-30-63(47)56(74)49(34(2)65)61-53(71)46(28-13-36-11-24-42(67)25-12-36)60-55(73)48-32-43(68)33-64(48)57(75)50(35(3)66)62-52(45)70/h11-12,14-27,34-35,43,45-50,65-68H,4-10,13,28-33H2,1-3H3,(H,58,72)(H,59,69)(H,60,73)(H,61,71)(H,62,70)/t34?,35?,43-,45+,46u,47u,48u,49?,50?/m1/s1/f/h58-62H

InChIKey: InChIKey=YUIFRQGKMVPYDJ-PXESLRLDDE
SMILES: CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)NC4CCCNC(=O)C5CCCN5C(=O)C(NC(=O)C(NC(=O)C6CC(CN6C(=O)C(NC4=O)C(C)O)O)CCC7=CC=C(C=C7)O)C(C)O

Names:
    AIDS-123255
    AIDS123255
    N-{(18S,11R)-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 493651
    PubChem ID 219527