AIDS-122674

Molecular Formula: C45H58N6O13


InChI: InChI=1/C45H58N6O13/c1-3-13-31(26-52)47-43(62)34(24-28-14-7-4-8-15-28)50-41(60)32(20-22-36(54)55)49-45(64)40(39(29-16-9-5-10-17-29)30-18-11-6-12-19-30)51-42(61)33(21-23-37(56)57)48-44(63)35(25-38(58)59)46-27(2)53/h3,5-6,9-12,16-19,26,28,31-35,39-40H,1,4,7-8,13-15,20-25H2,2H3,(H,46,53)(H,47,62)(H,48,63)(H,49,64)(H,50,60)(H,51,61)(H,54,55)(H,56,57)(H,58,59)/t31-,32-,33-,34-,35-,40-/m0/s1/f/h46-51,54,56,58H

InChIKey: InChIKey=BBDPSWRVFZTKBL-VQDUHGDFDQ
SMILES: CC(=O)NC(CC(=O)O)C(=O)NC(CCC(=O)O)C(=O)NC(C(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)NC(CCC(=O)O)C(=O)NC(CC3CCCCC3)C(=O)NC(CC=C)C=O

Names:
    AIDS-122674
    AIDS122674
    (4S)-4-[N-((1S)-1-{N-[(1S)-1-(N-{(1S)-1-[N-((1S)-2-Oxo-1-prop-2-enylethyl)carbamoyl]-2-cyclohexylethyl
    (4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-carboxy-propanoyl]amino]-4-carboxy-butanoyl]amino]-3,3-diphenyl-propanoyl]amino]-4-[[(1S)-2-cyclohexyl-1-[[(2S)-1-oxopent-4-en-2-yl]carbamoyl]ethyl]carbamoyl]butanoic acid

Registries:
    PubChem CID 493285
    PubChem ID 219063