HRID1150612

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

2 次

HCID312

Chloride

Cl-

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID1117

Sulfate

O4S-2

HCID6342

Acetonitrile

C2H3N

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl acetate

C4H8O2

HCID12790

2-Fluoroadenine

C5H4FN5

HCID13838

Hexamethyldisilazane

C6H19NSi2

结构：CC(=O)OC1OC(COC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C1OC(=O)c1ccccc1

HCID229578

1-O-Acetyl-2,3,5-tri-O-benzoylpentofuranose

C28H24O9

PRODUCTS

生成物

结构：Nc1nc(F)nc2c1ncn2C1OC(COC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C1OC(=O)c1ccccc1

HCID22912764

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8fbff6cc22ab4a2b8e7c153a65bec580
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[C:19]([O:20][CH:23]1[CH:24]([O:25][C:26]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)=[O:33])[CH:34]([O:35][C:36]([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)=[O:43])[CH:44]([CH2:46][O:47][C:48]([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)=[O:55])[O:45]1)(=[O:21])[CH3:22].[CH3:62][Si:63]([CH3:64])([CH3:65])[NH:66][Si:67]([CH3:68])([CH3:69])[CH3:70].[CH3:71][C:72]#[N:73].[CH3:77][CH2:78][O:79][C:80](=[O:81])[CH3:82].[Cl-:56].[Cl:74][CH2:75][Cl:76].[F:1][c:2]1[n:3][c:4]([NH2:11])[c:5]2[nH:6][cH:7][n:8][c:9]2[n:10]1.[NH4+:12].[NH4+:13].[Na+:61].[O-:14][S:15](=[O:16])(=[O:17])[O-:18].[O-:57][C:58]([OH:59])=[O:60]>>[F:1][c:2]1[n:3][c:4]([NH2:11])[c:5]2[n:6][cH:7][n:8]([CH:23]3[CH:24]([O:25][C:26]([c:27]4[cH:28][cH:29][cH:30][cH:31][cH:32]4)=[O:33])[CH:34]([O:35][C:36]([c:37]4[cH:38][cH:39][cH:40][cH:41][cH:42]4)=[O:43])[CH:44]([CH2:46][O:47][C:48]([c:49]4[cH:50][cH:51][cH:52][cH:53][cH:54]4)=[O:55])[O:45]3)[c:9]2[n:10]1