6,8-dimethyl-6,7-didehydroergoline

Chemical Formula:

C₁₆H₁₉N₂

Molecular Weight:

239.339 Daltons

Monoisotopic Mass:

239.15482362030002 Daltons

SMILES:

CC1(C=[N+](C)[CH]2(CC4(C3(=C([CH](C1)2)C=CC=C3NC=4))))

InChI:

1S/C16H19N2/c1-10-6-13-12-4-3-5-14-16(12)11(8-17-14)7-15(13)18(2)9-10/h3-5,8-10,13,15,17H,6-7H2,1-2H3/q+1/t10?,13-,15-/m1/s1

InChIKey:

FGVUDRMBAMEJCE-SKNXHYNKSA-N

Synonyms

(2R,7R)-4,6-dimethyl-6,11-diazatetracyclo[7.6.1.0^2,7.0^12,16]hexadeca-1(16),5,9,12,14-pentaen-6-ium

Databases

MetaCyc: CPD-14466

KEGG: C20409

PubChem (CID): 57339187

MetaboLights: MTBLC65034

ChEBI: 65034

MetaNetX: MNXM97125