Methanol → HCID 178440158, compound

HRID 1547698Notes

Reaction equation

HRID 1547698 reaction equation
[CH3:50][OH:51].[CH:1]([CH3:2])([CH3:3])[c:4]1[s:5][cH:6][c:7]([CH2:9][O:10][C:11](=[O:12])[NH:13][CH:14]([CH:15]([CH3:16])[CH3:17])[C:18](=[O:19])[OH:20])[n:8]1.[CH:52]([Cl:53])([Cl:54])[Cl:55].[NH2:21][CH:22]([CH2:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[CH:30]([CH2:31][CH:32]([CH2:33][c:34]1[cH:35][n:36][cH:37][s:38]1)[NH:39][C:40](=[O:41])[O:42][CH2:43][c:44]1[cH:45][n:46][cH:47][s:48]1)[OH:49]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[s:5][cH:6][c:7]([CH2:9][O:10][C:11](=[O:12])[NH:13][CH:14]([CH:15]([CH3:16])[CH3:17])[C:18](=[O:20])[NH:21][CH:22]([CH2:23][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[CH:30]([CH2:31][CH:32]([CH2:33][c:34]2[cH:35][n:36][cH:37][s:38]2)[NH:39][C:40](=[O:41])[O:42][CH2:43][c:44]2[cH:45][n:46][cH:47][s:48]2)[OH:49])[n:8]1

Participants

5

Sources & evidence

ORD record
ord-1ca0bb70399344acbddffdcf6c0cf493
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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