(2R)-2-[[(2R)-2-[[(2S)-2-(azepane-1-carbonylamino)-4-methyl-pentanoyl]amino]-3-(1-methylindol-3-yl)propanoyl]amino]-3-pyridin-2-yl-propanoic acid

Molecular Formula: C33H44N6O5


InChI: InChI=1/C33H44N6O5/c1-22(2)18-26(37-33(44)39-16-10-4-5-11-17-39)30(40)35-27(19-23-21-38(3)29-14-7-6-13-25(23)29)31(41)36-28(32(42)43)20-24-12-8-9-15-34-24/h6-9,12-15,21-22,26-28H,4-5,10-11,16-20H2,1-3H3,(H,35,40)(H,36,41)(H,37,44)(H,42,43)/t26-,27+,28+/m0/s1/f/h35-37,42H

InChIKey: InChIKey=LIOKMIQQPDDTNO-CASLCUHZDJ
SMILES: CC(C)CC(C(=O)NC(CC1=CN(C2=CC=CC=C21)C)C(=O)NC(CC3=CC=CC=N3)C(=O)O)NC(=O)N4CCCCCC4

Names:
    (2R)-2-[[(2R)-2-[[(2S)-2-(azepane-1-carbonylamino)-4-methyl-pentanoyl]amino]-3-(1-methylindol-3-yl)propanoyl]amino]-3-pyridin-2-yl-propanoic acid

Registries:
    PubChem CID 107810
    PubChem ID 10234447