Cyclohexanemethylamine → HCID 59352393, compound

HRID 196871Notes

Reaction equation

HRID 196871 reaction equation
[CH:10]1([CH2:11][NH2:12])[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17]1.[F:1][c:2]1[c:3]([CH3:9])[c:4]([NH2:5])[cH:6][cH:7][cH:8]1.[O:18]=[C:19]1[N:20]([CH2:39][c:40]2[cH:41][cH:42][c:43]([C:44](=[O:45])[OH:46])[cH:47][cH:48]2)[c:21]2[cH:22][cH:23][cH:24][cH:25][c:26]2[C:27]12[c:28]1[c:29]([cH:32][c:33]3[c:37]([cH:38]1)[CH2:36][CH2:35][O:34]3)[O:30][CH2:31]2.[O:49]=[C:50]1[C:51]2([CH2:52][O:53][c:54]3[cH:55][c:56]4[c:57]([cH:58][c:59]32)[CH2:60][CH2:61][O:62]4)[c:63]2[c:64]([cH:65][cH:66][cH:67][cH:68]2)[N:69]1[CH2:70][c:71]1[cH:72][c:73]([C:77]([OH:78])=[O:79])[cH:74][cH:75][cH:76]1>>[F:1][c:2]1[c:3]([CH3:9])[c:4]([NH:5][C:44]([c:43]2[cH:42][cH:41][c:40]([CH2:39][N:20]3[C:19](=[O:18])[C:27]4([c:26]5[c:21]3[cH:22][cH:23][cH:24][cH:25]5)[c:28]3[c:29]([cH:32][c:33]5[c:37]([cH:38]3)[CH2:36][CH2:35][O:34]5)[O:30][CH2:31]4)[cH:48][cH:47]2)=[O:45])[cH:6][cH:7][cH:8]1

Participants

5

Reactant 4

HCID 76688CyclohexanemethylamineHCID 2855533-Fluoro-2-methylanilineHCID 593522533-[(2'-oxo-5,6-dihydrospiro[benzo[1,2-b:5,4-b']difuran-3,3'-indol]-1'(2'H)-yl)methyl]benzoic acidHCID 593526094-[(2'-oxo-5,6-dihydrospiro[benzo[1,2-b:5,4-b']difuran-3,3'-indol]-1'(2'H)-yl)methyl]benzoic acid

Product 1

HCID 59352393HCID 59352393, compound

Sources & evidence

ORD record
ord-9ed152e77e69419fbdb967ee35723448
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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