HRID203366

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8173

1-Bromodecane

C10H21Br

HCID19660

Carbonate

CO3-2

结构：Oc1ccc(-c2c3nc(c(-c4ccc(O)cc4)c4ccc([nH]4)c(-c4ccc(O)cc4)c4nc(c(-c5ccc(O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

HCID135438030

4,4',4'',4'''-(Porphyrin-5,10,15,20-tetrayl)tetraphenol

C44H30N4O4

PRODUCTS

生成物

结构：CCCCCCCCCCOc1ccc(-c2c3nc(c(-c4ccc(O)cc4)c4ccc([nH]4)c(-c4ccc(O)cc4)c4nc(c(-c5ccc(O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

HCID135916063

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0fe71e88892441f4aaad0ee1ca82557c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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