NSC5120

Molecular Formula: C27H39NO9


InChI: InChI=1/C21H31NO2.C6H8O7/c1-16(2)22(4)17(3)15-24-21(23)20(18-11-7-5-8-12-18)19-13-9-6-10-14-19;7-3(8)1-6(13,5(11)12)2-4(9)10/h5,7-9,11-13,16-17,19-20H,6,10,14-15H2,1-4H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/f/h;7,9,11H

InChIKey: InChIKey=HCZCVKSENHBJGZ-BGDPYBRRCH
SMILES: CC(C)N(C)C(C)COC(=O)C(C1CCCC=C1)C2=CC=CC=C2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Names:
    NSC5120
    2-hydroxypropane-1,2,3-tricarboxylic acid; 2-(methyl-propan-2-yl-amino)propyl 2-(1-cyclohex-2-enyl)-2-phenyl-acetate
    5402-42-6

Registries:
    PubChem CID 221139
    PubChem ID 71276