BROMOCRIPTINE MESYLATE

PubChem Notes:

Bromocriptine A semisynthetic ergotamine alkaloid that is a dopamine D2 agonist. It suppresses prolactin secretion.

Molecular Formula: C33H44BrN5O8S


InChI: InChI=1/C32H40BrN5O5.CH4O3S/c1-16(2)12-24-29(40)37-11-7-10-25(37)32(42)38(24)30(41)31(43-32,17(3)4)35-28(39)18-13-20-19-8-6-9-22-26(19)21(27(33)34-22)14-23(20)36(5)15-18;1-5(2,3)4/h6,8-9,13,16-18,23-25,34,42H,7,10-12,14-15H2,1-5H3,(H,35,39);1H3,(H,2,3,4)/t18?,23-,24u,25+,31-,32?;/m1./s1/f/h35H;2H

InChIKey: InChIKey=NOJMTMIRQRDZMT-YUICLULDDX
SMILES: CC(C)CC1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C(C)C)NC(=O)C4CN(C5CC6=C(NC7=CC=CC(=C67)C5=C4)Br)C)O.CS(=O)(=O)O

Names:
    BROMOCRIPTINE MESYLATE

Registries:
    PubChem CID 5702014
    PubChem ID 8149225