HRID1445719

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CN1C[C@H](C(=O)O)C=C2c3cccc4[nH]cc(c34)C[C@H]21

HCID6717

Lysergic acid

C16H16N2O2

HCID7672

Phenyl isocyanate

C7H5NO

HCID8082

Piperidine

C5H11N

HCID31268

Pyrrolidine

C4H9N

结构：Cc1[nH]c2cccc3c2c1C[C@@H]1C3=C[C@@H](C(=O)O)CN1C

HCID13269012

未命名化合物

PRODUCTS

生成物

结构：Cc1[nH]c2cccc3c2c1CC1C3=CC(C(=O)N2CCCCC2)CN1C(=O)Nc1ccccc1

HCID68542692

未命名化合物

PROCEDURE

实验过程

5-Methyl-9-(piperidine-1-carbonyl)-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-7-carboxylic acid phenylamide is prepared following similar procedures as described for Example 45 using 2-methyl-lysergic acid (instead of lysergic acid) and piperidine (instead of pyrrolidine) in step 1 and phenyl isocyanate in step 3. MS: 455 (M+H)+

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-eac0eb8e4a9141c4897298e2d286440e
来源数据集: uspto-grants-2010_02
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07666877B2
来源说明: uspto-grants-2010_02

反应 SMILES

[CH3:1][C:2]1[NH:19][C:18]2[C:20]3[C:3]=1[CH2:4][C@@H:5]1[C:13]([C:14]=3[CH:15]=[CH:16][CH:17]=2)=[CH:12][C@@H:8]([C:9](=O)[OH:10])[CH2:7][N:6]1[CH3:21].OC([C@@H]1C=C2[C@@H](CC3[C:41]4[C:34](=[CH:35][CH:36]=[CH:37][C:38]2=4)[NH:33]C=3)N(C)C1)=O.[NH:42]1[CH2:47][CH2:46][CH2:45][CH2:44][CH2:43]1.N1CCCC1.C1(N=C=[O:61])C=CC=CC=1>>[C:34]1([NH:33][C:21]([N:6]2[CH:5]3[C:13]([C:14]4[CH:15]=[CH:16][CH:17]=[C:18]5[C:20]=4[C:3](=[C:2]([CH3:1])[NH:19]5)[CH2:4]3)=[CH:12][CH:8]([C:9]([N:42]3[CH2:47][CH2:46][CH2:45][CH2:44][CH2:43]3)=[O:10])[CH2:7]2)=[O:61])[CH:35]=[CH:36][CH:37]=[CH:38][CH:41]=1