AUA

Molecular Formula: C34H61N5O7S


InChI: InChI=1/C34H61N5O7S/c1-10-11-13-35-34(46)29(21(6)7)39-31(43)25-18-23(41)17-24(25)30(42)27(15-19(2)3)38-32(44)26(12-14-47-9)37-33(45)28(16-20(4)5)36-22(8)40/h19-21,24-30,42H,10-18H2,1-9H3,(H,35,46)(H,36,40)(H,37,45)(H,38,44)(H,39,43)/t24-,25-,26+,27+,28+,29+,30+/m1/s1/f/h35-39H

InChIKey: InChIKey=YFDLSIPCLMLOKZ-ARRNXAJSDI
SMILES: CCCCNC(=O)C(C(C)C)NC(=O)C1CC(=O)CC1C(C(CC(C)C)NC(=O)C(CCSC)NC(=O)C(CC(C)C)NC(=O)C)O

Names:
    AUA
    (1R,2R)-2-{(1S,2S)-2-[(S)-2-((S)-2-ACETYLAMINO-4-METHYL-PENTANOYLAMINO)-4-METHYLSULFANYL-BUTYRYLAMINO]-1-HYDROXY-4-METHYL-PENTYL
    (2S)-2-acetamido-N-[(1S)-1-[[(1S,2S)-1-[(1R,2R)-2-[[(1S)-1-(butylcarbamoyl)-2-methyl-propyl]carbamoyl]-4-oxo-cyclopentyl]-1-hydroxy-4-methyl-pentan-2-yl]carbamoyl]-3-methylsulfanyl-propyl]-4-methyl-pentanamide

Registries:
    PubChem CID 5494410
    PubChem ID 8149066