HRID190406

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

HCID2734844

2-Cyanoethyl N,N-diisopropylchlorophosphoramidite

C9H18ClN2OP

反应SMILES：COc1ccc(C(OCC(O)CCCCOc2ccc(C(OC(C)=O)OC(C)=O)cc2)(c2ccccc2)c2ccc(OC)cc2)cc1

HCID70010871

未命名化合物

PRODUCTS

产物

反应SMILES：COc1ccc(C(OCC(CCCCOc2ccc(C(OC(C)=O)OC(C)=O)cc2)OP(OCCC#N)N(C(C)C)C(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

HCID18551506

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-52a30216e09a4b38971474d35d28057a
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

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