HRID87915

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID6344

Dichloromethane

CH2Cl2

HCID7678

1-Phenylacetone

C9H10O

HCID8028

Tetrahydrofuran

C4H8O

结构：CCC1C=C(C)CC(C)CC(OC)C2OC(O)(C(=O)C(=O)N3C(O[SiH](C)C)CCCC3C(=O)OC(C(C)=CC3CCC(=O)C(OC)C3)C(C)C(C(C)(C)C)CC1=O)C(C)CC2OC

HCID178436255

未命名化合物

HCID178460664

未命名化合物

PRODUCTS

生成物

结构：CCC1C=C(C)CC(C)CC(OC)C2OC(O)(C(=O)C(=O)N3C(O[SiH](C)C)CCCC3C(=O)OC(C(C)=CC3CCC(O)(C(C(C)=O)c4ccccc4)C(OC)C3)C(C)C(C(C)(C)C)CC1=O)C(C)CC2OC

HCID178436253

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-23f40ad68b39452bbf20645f82ea8cf3
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

[CH2:11]([CH3:12])[CH:13]1[C:14](=[O:73])[CH2:15][CH:16]([C:69]([CH3:70])([CH3:71])[CH3:72])[CH:17]([CH3:68])[CH:18]([C:56](=[CH:57][CH:58]2[CH2:59][CH:60]([O:65][CH3:66])[C:61](=[O:64])[CH2:62][CH2:63]2)[CH3:67])[O:19][C:20](=[O:55])[CH:21]2[CH2:22][CH2:23][CH2:24][CH:25]([O:51][SiH:52]([CH3:53])[CH3:54])[N:26]2[C:27](=[O:50])[C:28](=[O:49])[C:29]2([OH:48])[CH:30]([CH3:47])[CH2:31][CH:32]([O:45][CH3:46])[CH:33]([CH:34]([O:42][CH3:43])[CH2:35][CH:36]([CH3:41])[CH2:37][C:38]([CH3:40])=[CH:39]1)[O:44]2.[CH3:1][C:2](=[O:3])[CH2:4][c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1.[CH:83]([O:84][Ti+:85]([O:86][CH:87]([CH3:88])[CH3:89])[O:90][CH:91]([CH3:92])[CH3:93])([CH3:94])[CH3:95].[Cl-:82].[Cl:79][CH2:80][Cl:81].[O:74]1[CH2:75][CH2:76][CH2:77][CH2:78]1>>[CH3:1][C:2](=[O:3])[CH:4]([c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[C:61]1([OH:64])[CH:60]([O:65][CH3:66])[CH2:59][CH:58]([CH:57]=[C:56]([CH:18]2[CH:17]([CH3:68])[CH:16]([C:69]([CH3:70])([CH3:71])[CH3:72])[CH2:15][C:14](=[O:73])[CH:13]([CH2:11][CH3:12])[CH:39]=[C:38]([CH3:40])[CH2:37][CH:36]([CH3:41])[CH2:35][CH:34]([O:42][CH3:43])[CH:33]3[CH:32]([O:45][CH3:46])[CH2:31][CH:30]([CH3:47])[C:29]([OH:48])([C:28](=[O:49])[C:27](=[O:50])[N:26]4[CH:21]([C:20](=[O:55])[O:19]2)[CH2:22][CH2:23][CH2:24][CH:25]4[O:51][SiH:52]([CH3:53])[CH3:54])[O:44]3)[CH3:67])[CH2:63][CH2:62]1