Methanol → HCID 178424773, compound

HRID 1556432Notes

Reaction equation

HRID 1556432 reaction equation
[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[CH3:17][c:18]1[c:19](-[c:25]2[cH:26][cH:27][c:28]([C:35](=[O:36])[OH:37])[c:29]3[n:30][cH:31][cH:32][n:33][c:34]23)[c:20]([CH3:24])[cH:21][cH:22][cH:23]1.[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([CH2:8][c:9]2[n:10][c:11]([N+:14]([O-:15])=[O:16])[nH:12][cH:13]2)[CH2:6][CH2:7]1.[CH3:38][OH:39].[CH3:45][OH:46].[CH3:50][OH:51].[Cl:47][CH2:48][Cl:49]>>[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([CH2:8][c:9]2[n:10][c:11]([NH:14][C:35]([c:28]3[cH:27][cH:26][c:25](-[c:19]4[c:18]([CH3:17])[cH:23][cH:22][cH:21][c:20]4[CH3:24])[c:34]4[c:29]3[n:30][cH:31][cH:32][n:33]4)=[O:36])[nH:12][cH:13]2)[CH2:6][CH2:7]1

Participants

6

Sources & evidence

ORD record
ord-8cf12e31142a4fa7aa934e54255e6440
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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