HRID665437

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID8028

Tetrahydrofuran

C4H8O

结构：Cc1c(Cc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c(C)c(Cc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c(C)c1Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

HCID74370

Ionox 330

C54H78O3

HCID13696086

未命名化合物

PRODUCTS

生成物

HCID13696092

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b01e242594c5465e8b1802f9a8bd3123
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:16]([c:17]1[cH:18][c:19]([CH2:28][c:29]2[c:30]([CH3:31])[c:32]([CH2:33][c:34]3[cH:35][c:36]([C:37]([CH3:38])([CH3:39])[CH3:40])[c:41]([OH:42])[c:43]([C:44]([CH3:45])([CH3:46])[CH3:47])[cH:48]3)[c:49]([CH3:50])[c:51]([CH2:52][c:53]3[cH:54][c:55]([C:56]([CH3:57])([CH3:58])[CH3:59])[c:60]([OH:61])[c:62]([C:63]([CH3:64])([CH3:65])[CH3:66])[cH:67]3)[c:68]2[CH3:69])[cH:20][c:21]([C:22]([CH3:23])([CH3:24])[CH3:25])[c:26]1[OH:27])([CH3:70])([CH3:71])[CH3:72].[CH2:75]1[O:76][CH2:77][CH2:78][CH2:79]1.[CH:1](=[CH2:2])[c:3]1[cH:4][cH:5][c:6]([CH:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[CH3:15])[cH:7][cH:8]1.[Na+:74].[OH-:73]>>[CH:1](=[CH2:2])[c:3]1[cH:4][cH:5][c:6]([CH:9]([C:10](=[O:11])[OH:12])[CH3:15])[cH:7][cH:8]1