HRID942151

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

结构：c1ccc2c(c1)nnn2O[P+](N1CCCC1)(N1CCCC1)N1CCCC1

HCID2724700

未命名化合物

结构：CC1CN(Cc2ccccc2)CC1(CC(=O)OC(C)(C)C)C(=O)O

HCID71293661

未命名化合物

HCID86678242

未命名化合物

PRODUCTS

生成物

结构：CCCC(F)CN1CCC(NC(=O)C2(CC(=O)OC(C)(C)C)CN(Cc3ccccc3)CC2C)CC1

HCID71293808

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bad40bfe9ace443389502c9b7f12b2ee
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][C:10]([C:14](=[O:15])[OH:16])([CH2:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH:11]([CH3:13])[CH2:12]1.[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH3:79][N:80]([CH3:81])[CH:82]=[O:83].[F:25][CH:26]([CH2:27][N:28]1[CH2:29][CH2:30][CH:31]([NH2:34])[CH2:32][CH2:33]1)[CH2:35][CH2:36][CH3:37].[OH2:78].[P-:45]([F:46])([F:47])([F:48])([F:49])([F:50])[F:51].[n:52]1([O:53][P+:54]([N:55]2[CH2:56][CH2:57][CH2:58][CH2:59]2)([N:60]2[CH2:61][CH2:62][CH2:63][CH2:64]2)[N:65]2[CH2:66][CH2:67][CH2:68][CH2:69]2)[c:70]2[cH:71][cH:72][cH:73][cH:74][c:75]2[n:76][n:77]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][C:10]([C:14](=[O:16])[NH:34][CH:31]2[CH2:30][CH2:29][N:28]([CH2:27][CH:26]([F:25])[CH2:35][CH2:36][CH3:37])[CH2:33][CH2:32]2)([CH2:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH:11]([CH3:13])[CH2:12]1