HRID803013

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID887

Methanol

CH4O

HCID962

Water

H2O

HCID6597

Dichloroacetic acid

C2H2Cl2O2

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

结构：CCOP(=O)(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)OCC

HCID10573715

Diethyl(triphenylphosphoranylidene)methylphosphonate

C23H26O3P2

结构：CC1(C)OC2C(CO)OC(n3ncc4c(NC(=O)c5ccccc5)ncnc43)C2O1

HCID178431260

未命名化合物

PRODUCTS

生成物

结构：CCOP(=O)(C=CC1OC(n2ncc3c(NC(=O)c4ccccc4)ncnc32)C2OC(C)(C)OC12)OCC

HCID178476892

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5b0e6a52cd9a4387a726039a8e765c3f
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:52]([CH3:53])[O:54][P:55](=[O:56])([O:57][CH2:58][CH3:59])[CH:60]=[P:61]([c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1)([c:68]1[cH:69][cH:70][cH:71][cH:72][cH:73]1)[c:74]1[cH:75][cH:76][cH:77][cH:78][cH:79]1.[CH3:80][S:81](=[O:82])[CH3:83].[CH3:85][OH:86].[CH:37]1([N:38]=[C:39]=[N:40][CH:41]2[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46]2)[CH2:47][CH2:48][CH2:49][CH2:50][CH2:51]1.[OH2:84].[OH:1][CH2:2][CH:3]1[O:4][CH:5]([n:13]2[n:14][cH:15][c:16]3[c:17]2[n:18][cH:19][n:20][c:21]3[NH:22][C:23]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)=[O:30])[CH:6]2[CH:7]1[O:8][C:9]([CH3:11])([CH3:12])[O:10]2.[OH:31][C:32]([CH:33]([Cl:34])[Cl:35])=[O:36]>>[CH:2]([CH:3]1[O:4][CH:5]([n:13]2[n:14][cH:15][c:16]3[c:17]2[n:18][cH:19][n:20][c:21]3[NH:22][C:23]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)=[O:30])[CH:6]2[CH:7]1[O:8][C:9]([CH3:11])([CH3:12])[O:10]2)=[CH:60][P:55]([O:54][CH2:52][CH3:53])(=[O:56])[O:57][CH2:58][CH3:59]