Benzoylhypaconine hydrobromide

Molecular Formula: C31H44BrNO9


InChI: InChI=1/C31H43NO9.BrH/c1-32-14-28(15-37-2)12-11-18(38-3)30-17-13-29(35)25(41-27(34)16-9-7-6-8-10-16)19(17)31(36,24(33)26(29)40-5)20(23(30)32)21(39-4)22(28)30;/h6-10,17-26,33,35-36H,11-15H2,1-5H3;1H/t17-,18?,19-,20u,21?,22-,23-,24?,25?,26+,28u,29-,30u,31-;/m1./s1/fC31H44NO9.Br/h32H;1h/q+1;-1

InChIKey: InChIKey=MIQLJRZMAHBESK-WRAIHGBBDC
SMILES: C[NH+]1CC2(CCC(C34C2C(C(C31)C5(C6C4CC(C6OC(=O)C7=CC=CC=C7)(C(C5O)OC)O)O)OC)OC)COC.[Br-]

Names:
    Aconitane-8,13,14,15-tetrol, 4-(methoxymethyl)-20-methyl-1,6,16-trimethoxy-, 14-benzoate, hydrobromide, (1-alpha,6-alpha,14-alpha,15-alpha,16-beta)-
    ACONITANE-8,13,14,15-TETROL, 4-(METHOXYMETHYL)-20-METHYL-1,6,16-TRIMETHOXY-, 14-
    Benzoylhypaconine hydrobromide
    71402-62-5

Registries:
    PubChem CID 51313
    PubChem ID 189535