Chem
J-GLOBAL ID:200907017034822930   Nikkaji number:J1.080.825A

1-Isopropyl-6-methyl-8,9-didehydroergoline-8-methanol

1-イソプロピル-6-メチル-8,9-ジデヒドロエルゴリン-8-メタノール
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C19H24N2O
Molecular formula furigana: C19-H24-N2-O
Molecular weight: 296.414
InChI: InChI=1S/C19H24N2O/c1-12(2)21-10-14-8-18-16(7-13(11-22)9-20(18)3)15-5-4-6-17(21)19(14)15/h4-7,10,12,16,18,22H,8-9,11H2,1-3H3/t16-,18-/m1/s1
InChI key: NIBSEOVSYUWHPP-SJLPKXTDSA-N
SMILES: CC(C)n1cc2C[C@@H]3[C@H](C=C(CO)CN3C)c3cccc1c23
Systematic name  (4):
  • (6aR)-4-イソプロピル-7-メチル-4,6,6aα,7,8,10aβ-ヘキサヒドロインドロ[4,3-fg]キノリン-9-メタノール
  • 1-イソプロピル-6-メチル-8,9-ジデヒドロエルゴリン-8-メタノール
  • [(2R,7R)-6-メチル-11-(プロパン-2-イル)-6,11-ジアザテトラシクロ[7.6.1.02,7.012,16]ヘキサデカ-1(16),3,9,12,14-ペンタエン-4-イル]メタノール
  • [(2R,7R)-6-methyl-11-(propan-2-yl)-6,11-diazatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),3,9,12,14-pentaen-4-yl]methanol
Other name (2):
  • (6aR)-4-Isopropyl-7-methyl-4,6,6aα,7,8,10aβ-hexahydroindolo[4,3-fg]quinoline-9-methanol
  • 1-Isopropyl-6-methyl-8,9-didehydroergoline-8-methanol
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