1-Butanol → HCID 59242083, compound

HRID 289735Notes

Reaction equation

HRID 289735 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][CH2:8][CH2:9][NH:10][c:11]1[n:12][c:13]2[cH:14][cH:15][c:16]([O:31][CH3:32])[cH:17][c:18]2[c:19]([N:21]([CH3:22])[c:23]2[cH:24][cH:25][c:26]([O:29][CH3:30])[cH:27][cH:28]2)[n:20]1)([CH3:5])([CH3:6])[CH3:33].[C:57]([O:58][C:59](=[O:60])[NH:61][CH2:62][CH2:63][NH2:64])([CH3:65])([CH3:66])[CH3:67].[CH2:77]([OH:78])[CH2:79][CH2:80][CH3:81].[CH:68]([N:69]([CH:70]([CH3:71])[CH3:72])[CH2:73][CH3:74])([CH3:75])[CH3:76].[Cl:34][c:35]1[n:36][c:37]([N:38]([c:39]2[cH:40][cH:41][c:42]([O:43][CH3:44])[cH:45][cH:46]2)[CH3:47])[c:48]2[c:49]([cH:50][cH:51][c:52]([O:53][CH3:54])[cH:55]2)[n:56]1>>[NH2:7][CH2:8][CH2:9][NH:10][c:11]1[n:12][c:13]2[cH:14][cH:15][c:16]([O:31][CH3:32])[cH:17][c:18]2[c:19]([N:21]([CH3:22])[c:23]2[cH:24][cH:25][c:26]([O:29][CH3:30])[cH:27][cH:28]2)[n:20]1

Participants

6

Reactant 5

HCID 2631-ButanolHCID 81531DiisopropylethylamineHCID 187201N-BOC-ethylenediamineHCID 59237269HCID 59237269, compoundHCID 59242113HCID 59242113, compound

Product 1

HCID 59242083HCID 59242083, compound

Sources & evidence

ORD record
ord-d460f0327a474cdab5e00e1c8c44b46c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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