Chem
J-GLOBAL ID：200907078258228447   Nikkaji number：J15.145I

MLD-41

1-メチルリセルグ酸ジエチルアミド
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： C21H27N3O
Molecular formula furigana： C21-H27-N3-O
Molecular weight： 337.467
InChI： InChI=1S/C21H27N3O/c1-5-24(6-2)21(25)15-10-17-16-8-7-9-18-20(16)14(12-22(18)3)11-19(17)23(4)13-15/h7-10,12,15,19H,5-6,11,13H2,1-4H3/t15-,19-/m1/s1
InChI key： VQZYKSWQIQANKB-DNVCBOLYSA-N
SMILES： CCN(CC)C(=O)[C@H]1CN(C)[C@@H]2Cc3cn(C)c4cccc(C2=C1)c34
Systematic name  (4)：
  • N,N-ジエチル-1,6-ジメチルエルゴリン-9-エン-8β-カルボアミド
  • 9,10-ジデヒドロ-N,N-ジエチル-1,6-ジメチルエルゴリン-8β-カルボアミド
  • (4R,7R)-N,N-ジエチル-6,11-ジメチル-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),2,9,12,14-ペンタエン-4-カルボキサミド
  • (4R,7R)-N,N-diethyl-6,11-dimethyl-6,11-diazatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),2,9,12,14-pentaene-4-carboxamide
Other name (5)：
  • 1-メチルリセルグ酸ジエチルアミド
  • 1-Methyllysergic acid diethylamide
  • MLD-41
  • 9,10-Didehydro-N,N-diethyl-1,6-dimethylergoline-8β-carboxamide
  • N,N-Diethyl-1,6-dimethylergolin-9-ene-8β-carboxamide
CAS registry number： 4238-85-1
Regulation number (1)：
  • KE3000000
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