AIDS-123036

Molecular Formula: C38H51N9O8


InChI: InChI=1/C38H51N9O8/c1-5-27-24(4)42-37(53)35(28(27)18-25-16-22(2)15-23(3)17-25)43-33(51)10-8-9-31(49)40-13-6-7-14-41-32(50)12-11-26-20-47(38(54)44-36(26)52)34-19-29(45-46-39)30(21-48)55-34/h15-17,20,29-30,34,48H,5-14,18-19,21H2,1-4H3,(H,40,49)(H,41,50)(H,42,53)(H,43,51)(H,44,52,54)/t29-,30+,34+/m0/s1/f/h40-44H

InChIKey: InChIKey=OEXATDIYOYVLIK-UBEOJXGCDQ
SMILES: CCC1=C(NC(=O)C(=C1CC2=CC(=CC(=C2)C)C)NC(=O)CCCC(=O)NCCCCNC(=O)CCC3=CN(C(=O)NC3=O)C4CC(C(O4)CO)N=[N+]=[N-])C

Names:
    AIDS-123036
    AIDS123036
    N'-[4-[3-[1-[(2R,4S,5R)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxo-pyrimidin-5-yl]propanoylamino]butyl]-N-[4-[(3,5-dimethylphenyl)methyl]-5-ethyl-6-methyl-2-oxo-1H-pyridin-3-yl]pentanediamide
    3'-Azido-2',3'-dideoxy-5-[N-15-[4-(3,5-dimethylbenzyl)-5-ethyl-6-methyl-2-oxo-(1H)-pyridin-3-yl]-4,9,15-triaza-3,10,14-trioxopentadecanyl]uridine

Registries:
    PubChem CID 493567
    PubChem ID 219400