AIDS-123699

Molecular Formula: C33H48N4O6


InChI: InChI=1/C33H48N4O6/c1-20(2)16-26(29(34)38)35-31(40)28-18-22-12-6-7-13-23(22)19-37(28)32(41)27(17-21-10-4-3-5-11-21)36-30(39)24-14-8-9-15-25(24)33(42)43/h6-7,12-13,20-21,24-28H,3-5,8-11,14-19H2,1-2H3,(H2,34,38)(H,35,40)(H,36,39)(H,42,43)/t24-,25-,26+,27+,28+/m1/s1/f/h35-36,42H,34H2

InChIKey: InChIKey=OPMWQRGHZLQCAP-FWUAAENPDL
SMILES: CC(C)CC(C(=O)N)NC(=O)C1CC2=CC=CC=C2CN1C(=O)C(CC3CCCCC3)NC(=O)C4CCCCC4C(=O)O

Names:
    AIDS-123699
    AIDS123699
    (1R,2R)-2-[[(2S)-1-[(3S)-3-[[(1S)-1-carbamoyl-3-methyl-butyl]carbamoyl]-3,4-dihydro-1H-isoquinolin-2-yl]-3-cyclohexyl-1-oxo-propan-2-yl]carbamoyl]cyclohexane-1-carboxylic acid
    (1R,2R)-2-{(S)-2-[(S)-3-((S)-1-Carbamoyl-3-methyl-butylcarbamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]-1-cyclohexylmethyl-2-oxo-ethylcarbamoyl

Registries:
    PubChem CID 493935
    PubChem ID 219827