Methanol → HCID 72272927, compound

HRID 1135134Notes

Reaction equation

HRID 1135134 reaction equation
[C:10]([CH3:11])([CH3:12])([CH3:13])[O:14][C:15](=[O:16])[N:17]1[CH:18]([CH2:21][O:22][c:23]2[cH:24][c:25](-[c:29]3[cH:30][c:31]([CH2:35][CH2:36][CH2:37][NH2:38])[cH:32][cH:33][cH:34]3)[cH:26][n:27][cH:28]2)[CH2:19][CH2:20]1.[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[CH3:3][C:4](=[O:5])[O:6][C:7](=[O:8])[CH3:9].[CH3:46][N:47]([CH3:48])[c:49]1[cH:50][cH:51][n:52][cH:53][cH:54]1.[CH3:58][CH2:59][O:60][C:61]([CH3:62])=[O:63].[CH3:64][OH:65].[CH3:69][OH:70].[Cl:55][CH2:56][Cl:57].[Cl:66][CH2:67][Cl:68].[N:1]#[N:2]>>[CH3:3][C:4](=[O:5])[NH:38][CH2:37][CH2:36][CH2:35][c:31]1[cH:30][c:29](-[c:25]2[cH:24][c:23]([O:22][CH2:21][CH:18]3[N:17]([C:15]([O:14][C:10]([CH3:11])([CH3:12])[CH3:13])=[O:16])[CH2:20][CH2:19]3)[cH:28][n:27][cH:26]2)[cH:34][cH:33][cH:32]1

Participants

9

Sources & evidence

ORD record
ord-80298b0f1c93432f8e3ec033f49741f8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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