HRID2346238

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

结构：CCOC(C)OC(C)(C)C(F)CCC(CI)C1CCC2C3CC=C4CC(OC5CCCCO5)CC(OC5CCCCO5)C4(C)C3CCC12C

HCID178468013

未命名化合物

PRODUCTS

生成物

结构：CCOC(C)OC(C)(C)C(F)CCC(C)C1CCC2C3CC=C4CC(OC5CCCCO5)CC(OC5CCCCO5)C4(C)C3CCC12C

HCID178468012

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7f3cfdd9832744c78f986b8f3e14628e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[O:1]1[CH:2]([O:7][CH:8]2[CH2:9][CH:10]([O:43][CH:44]3[O:45][CH2:46][CH2:47][CH2:48][CH2:49]3)[CH2:11][C:12]3=[CH:13][CH2:14][CH:15]4[CH:16]5[CH2:17][CH2:18][CH:19]([CH:20]([CH2:21][CH2:22][CH:23]([C:24]([CH3:25])([CH3:26])[O:27][CH:28]([CH3:29])[O:30][CH2:31][CH3:32])[F:33])[CH2:34][I:35])[C:36]5([CH3:42])[CH2:37][CH2:38][CH:39]4[C:40]23[CH3:41])[CH2:3][CH2:4][CH2:5][CH2:6]1.[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1>>[O:1]1[CH:2]([O:7][CH:8]2[CH2:9][CH:10]([O:43][CH:44]3[O:45][CH2:46][CH2:47][CH2:48][CH2:49]3)[CH2:11][C:12]3=[CH:13][CH2:14][CH:15]4[CH:16]5[CH2:17][CH2:18][CH:19]([CH:20]([CH2:21][CH2:22][CH:23]([C:24]([CH3:25])([CH3:26])[O:27][CH:28]([CH3:29])[O:30][CH2:31][CH3:32])[F:33])[CH3:34])[C:36]5([CH3:42])[CH2:37][CH2:38][CH:39]4[C:40]23[CH3:41])[CH2:3][CH2:4][CH2:5][CH2:6]1