HRID947450

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID8902

Dipropylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

HCID182776

Benzoic acid, 3-((dipropylamino)carbonyl)-, methyl ester

C15H21NO3

HCID335255

1-(tert-Butoxycarbonyl)-4-hydroxyproline

C10H17NO5

HCID601880

3-(Methoxycarbonyl)benzoic acid

C9H8O4

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

PRODUCTS

生成物

HCID182769

Benzoic acid, 3-((dipropylamino)carbonyl)-

C14H19NO3

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e6f8113f44ac41d495baf06cca719e36
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

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