O-Methyltyramine → HCID 59352524, compound

HRID 2127391Notes

Reaction equation

HRID 2127391 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:9][CH2:10][NH2:11])[cH:7][cH:8]1.[CH:12]1([CH2:13][NH2:14])[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]1.[O:20]=[C:21]1[N:22]([CH2:41][c:42]2[c:43]([C:44](=[O:45])[OH:46])[cH:47][cH:48][cH:49][cH:50]2)[c:23]2[cH:24][cH:25][cH:26][cH:27][c:28]2[C:29]12[c:30]1[c:31]([cH:34][c:35]3[c:39]([cH:40]1)[CH2:38][CH2:37][O:36]3)[O:32][CH2:33]2.[O:51]=[C:52]1[C:53]2([CH2:54][O:55][c:56]3[cH:57][c:58]4[c:59]([cH:60][c:61]32)[CH2:62][CH2:63][O:64]4)[c:65]2[c:66]([cH:67][cH:68][cH:69][cH:70]2)[N:71]1[CH2:72][c:73]1[cH:74][c:75]([C:79]([OH:80])=[O:81])[cH:76][cH:77][cH:78]1>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:9][CH2:10][NH:11][C:44]([c:43]2[c:42]([CH2:41][N:22]3[C:21](=[O:20])[C:29]4([c:28]5[c:23]3[cH:24][cH:25][cH:26][cH:27]5)[c:30]3[c:31]([cH:34][c:35]5[c:39]([cH:40]3)[CH2:38][CH2:37][O:36]5)[O:32][CH2:33]4)[cH:50][cH:49][cH:48][cH:47]2)=[O:45])[cH:7][cH:8]1

Participants

5

Reactant 4

HCID 4657O-MethyltyramineHCID 76688CyclohexanemethylamineHCID 593522533-[(2'-oxo-5,6-dihydrospiro[benzo[1,2-b:5,4-b']difuran-3,3'-indol]-1'(2'H)-yl)methyl]benzoic acidHCID 593523082-[(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 59352524HCID 59352524, compound

Sources & evidence

ORD record
ord-1e073fc5227a4669b3553c6c93b5afc7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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