N-Piperoylisoleucin

Molecular Formula: C18H21NO5


InChI: InChI=1/C18H21NO5/c1-3-12(2)17(18(21)22)19-16(20)7-5-4-6-13-8-9-14-15(10-13)24-11-23-14/h4-10,12,17H,3,11H2,1-2H3,(H,19,20)(H,21,22)/b6-4+,7-5+/t12u,17-/m0/s1/f/h19,21H

InChIKey: InChIKey=MIPFNQPZGSXYMX-JNSUFXTHDX
SMILES: CCC(C)C(C(=O)O)NC(=O)C=CC=CC1=CC2=C(C=C1)OCO2

Names:
    L-ISOLEUCINE, N-(5-(1,3-BENZODIOXOL-5-YL)-1-OXO-2,4-PENTADIENYL)-
    N-Piperoylisoleucin
    N-(5-(1,3-Benzodioxol-5-yl)-1-oxo-2,4-pentadienyl)-L-isoleucin
    (2S)-2-[[(2E,4E)-5-benzo[1,3]dioxol-5-ylpenta-2,4-dienoyl]amino]-3-methyl-pentanoic acid
    90778-81-7

Registries:
    PubChem CID 6435491
    PubChem ID 193462