POBILUKAST EDAMINE

Molecular Formula: C₂₈H₄₂N₂O₅S

InChI: InChI=1/C26H34O5S.C2H8N2/c27-23(28)18-19-32-25(24(29)26(30)31)22-17-11-10-16-21(22)15-9-4-2-1-3-6-12-20-13-7-5-8-14-20;3-1-2-4/h5,7-8,10-11,13-14,16-17,24-25,29H,1-4,6,9,12,15,18-19H2,(H,27,28)(H,30,31);1-4H2/t24-,25-;/m1./s1/fC26H32O5S.C2H10N2/h;3-4H/q-2;+2

InChIKey: InChIKey=GWUGCYFQFVTHBT-HLZNLVMVDG
SMILES: C1=CC=C(C=C1)CCCCCCCCC2=CC=CC=C2C(C(C(=O)[O-])O)SCCC(=O)[O-].C(C[NH3+])[NH3+]

Names:
    Pobilukast edamine [USAN]
    POBILUKAST EDAMINE
    137232-03-2
    2-azaniumylethylazanium; 3-[(1S,2R)-2-carboxylato-2-hydroxy-1-[2-(8-phenyloctyl)phenyl]ethyl]sulfanylpropanoate

Registries:
    PubChem CID 60841
    PubChem ID 197080