HRID94446

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID11776

Triphenylphosphine

C18H15P

HCID73042

1,1′-(1,2-Diazenediyl)bis[1-(1-piperidinyl)methanone]

C12H20N4O2

HCID13548135

(4-Pentylcyclohexyl)methanol

C12H24O

结构：Cc1ccc(-c2ccc(OCc3ccccc3)cc2)n1CCc1ccc(O)cc1

HCID22387567

未命名化合物

PRODUCTS

生成物

结构：CCCCCC1CCC(COc2ccc(CCn3c(C)ccc3-c3ccc(OCc4ccccc4)cc3)cc2)CC1

HCID22387506

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-052663e4969d4c8ba5a979b596eec4e6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[n:16]([CH2:21][CH2:22][c:23]3[cH:24][cH:25][c:26]([OH:29])[cH:27][cH:28]3)[c:17]([CH3:20])[cH:18][cH:19]2)[cH:13][cH:14]1.[CH2:30]([CH2:31][CH2:32][CH2:33][CH3:34])[CH:35]1[CH2:36][CH2:37][CH:38]([CH2:41][OH:42])[CH2:39][CH2:40]1.[CH3:80][c:81]1[cH:82][cH:83][cH:84][cH:85][cH:86]1.[N:62]([C:63]([N:64]1[CH2:65][CH2:66][CH2:67][CH2:68][CH2:69]1)=[O:70])=[N:71][C:72]([N:73]1[CH2:74][CH2:75][CH2:76][CH2:77][CH2:78]1)=[O:79].[OH2:87].[c:43]1([P:44]([c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)[cH:57][cH:58][cH:59][cH:60][cH:61]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[n:16]([CH2:21][CH2:22][c:23]3[cH:24][cH:25][c:26]([O:29][CH2:41][CH:38]4[CH2:37][CH2:36][CH:35]([CH2:30][CH2:31][CH2:32][CH2:33][CH3:34])[CH2:40][CH2:39]4)[cH:27][cH:28]3)[c:17]([CH3:20])[cH:18][cH:19]2)[cH:13][cH:14]1