Metergolina

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Properties Simple | Detailed

Formula C25H29N3O2
IUPAC Name benzyl n-[[(6ar,7r,9s,10ar)-4,7-dimethyl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-4-ium-9-yl]methyl]carbamate
Molecular Mass 403.517 g·mol−1
Heat of Formation -121.6 ± 16.7 kJ·mol−1
Dipole Moment 5.76 ± 1.08 D
Volume 502.17 Å 3
Surface Area 377.52 Å 2
HOMO Energy -8.08 ± 0.55 eV
LUMO Energy 0.14 ± eV
Point Group Symmetry C1
Synonyms
  • (((8-beta)-1,6-dimethylergolin-8-yl)methyl)carbamic acid phenylmethyl ester
  • (+)-n-(carboxy)-1-methyl-9,10-dihydrolysergamine benzyl ester
  • 1,6-dimethyl-8-beta-carbobenzyloxaminomethyl-10-alpha-ergoline
  • 1-methyl-8-beta-carbobenzyloxyaminomethyl-10-alpha-ergoline
  • 1-methyl-n-carbobenzyloxydihydro-d-lysergamin
  • [(8beta)-1,6-dimethylergolin-8-yl)methyl]carbamic acid phenylmethyl ester
  • ahr 3009
  • benzyl 1,6-dimethylergolin-8beta-ylmethylcarbamat
  • biomol-nt_000134
  • bpbio1_000287
  • bpbio1_000537
  • carbamic acid, (((8-beta)-1,6-dimethylergolin-8-yl)methyl)-, benzyl ester
  • carbamic acid, (((8-beta)-1,6-dimethylergolin-8-yl)methyl)-, phenylmethyl ester (9ci)
  • carbamic acid, (((8beta)-1,6-dimethylergolin-8-yl)methyl)-, phenylmethyl ester
  • carbamic acid, ((1,6-dimethylergolin-8-beta-yl)methyl)-, benzyl ester
  • d-8-beta-((carbobenzoxyamino)methyl)-1,6-dimethyl-10-alpha-ergoline
  • d-8-beta-((carboxyamino)methyl)-1,6-dimethylergoline i benzyl ester
  • d-n-carbobenzoxydihydro-1-methyllysergamine i
  • d-n-carboxydihydro-1-methyllysergamine i benzyl ester
  • fi 6337
  • liserdol
  • lysergamine, n-carboxy-9,10-dihydro-1-methyl-, benzyl ester (7ci)
  • metergolin
  • metergolina [dcit]
  • metergolina [spanish]
  • metergoline
  • metergoline [ban:inn]
  • metergolinum [latin]
  • methergoline
  • n-cbz-[(8beta)-1,6-dimethylergolin-8-yl]methylamine
  • substance 355/255
InChIKey WZHJKEUHNJHDLS-QTGUNEKASA-N
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