Molecule Info: Metisergide
Smiles:
CC[C@H](NC(=O)[C@H]1CN(C)[C@H]2C(=C1)c1cccc3c1c(C2)cn3C)CO
InChIKey:
KPJZHOPZRAFDTN-YBSCGTCVNA-N
InChI:
1/C21H27N3O2/c1-4-15(12-25)22-21(26)14-8-17-16-6-5-7-18-20(16)13(10-23(18)2)9-19(17)24(3)11-14/h5-8,10,14-15,19,25H,4,9,11-12H2,1-3H3,(H,22,26)/t14-,15+,19-/m1/s1/f/h22H
InChIcol:
1
More information (from its Standard Form):
Metisergide
References in which this molecule is mentioned:
National Center for Biotechnology Information. PubChem Compound Database. None. Information for this molecule was obtained via PubChem API and RDKit tools. None None (None). doi: None.