HRID680526

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID392871

1-(tert-Butoxycarbonyl)-4-piperidinecarboxylic acid

C11H19NO4

结构：c1ccc2c(c1)nnn2O[P+](N1CCCC1)(N1CCCC1)N1CCCC1

HCID2724700

未命名化合物

结构：O=C(NC(CCCc1ccccc1)CCCc1ccccc1)C1CCNCC1

HCID12020260

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC(C(=O)NC(CCCc3ccccc3)CCCc3ccccc3)CC2)CC1

HCID18727505

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6b4b1901f33f45f7898e493929c77f1f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:29]([CH3:30])([CH3:31])([CH3:32])[O:33][C:34](=[O:35])[N:36]1[CH2:37][CH2:38][CH:39]([C:42](=[O:43])[OH:44])[CH2:40][CH2:41]1.[CH2:87]([Cl:88])[Cl:89].[CH:45]([N:46]([CH2:47][CH3:48])[CH:49]([CH3:50])[CH3:51])([CH3:52])[CH3:53].[P-:54]([F:55])([F:56])([F:57])([F:58])([F:59])[F:60].[c:1]1([CH2:7][CH2:8][CH2:9][CH:10]([CH2:11][CH2:12][CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[NH:20][C:21](=[O:22])[CH:23]2[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[n:61]1([O:62][P+:63]([N:64]2[CH2:65][CH2:66][CH2:67][CH2:68]2)([N:69]2[CH2:70][CH2:71][CH2:72][CH2:73]2)[N:74]2[CH2:75][CH2:76][CH2:77][CH2:78]2)[c:79]2[cH:80][cH:81][cH:82][cH:83][c:84]2[n:85][n:86]1>>[c:1]1([CH2:7][CH2:8][CH2:9][CH:10]([CH2:11][CH2:12][CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[NH:20][C:21](=[O:22])[CH:23]2[CH2:24][CH2:25][N:26]([C:42]([CH:39]3[CH2:38][CH2:37][N:36]([C:34]([O:33][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:35])[CH2:41][CH2:40]3)=[O:43])[CH2:27][CH2:28]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1