Methanol → HCID 178471451, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH:8]([CH:9]([O:10][CH2:11][CH3:12])[O:13][CH2:14][CH3:15])[NH:16][S:17](=[O:18])(=[O:19])[c:20]1[c:21]([OH:30])[cH:22][c:23]([NH:26][C:27]([CH3:28])=[O:29])[cH:24][cH:25]1)=[O:31].[CH3:76][OH:77].[O:64]=[C:65]([O:66][CH2:67][CH3:68])[N:69]=[N:70][C:71]([O:72][CH2:73][CH3:74])=[O:75].[O:78]1[CH2:79][CH2:80][CH2:81][CH2:82]1.[c:45]1([P:46]([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[cH:59][cH:60][cH:61][cH:62][cH:63]1.[n:32]1([CH2:41][CH:42]([OH:43])[CH3:44])[n:33][cH:34][c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]12>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH:8]([CH:9]([O:10][CH2:11][CH3:12])[O:13][CH2:14][CH3:15])[NH:16][S:17](=[O:18])(=[O:19])[c:20]1[c:21]([O:30][CH:42]([CH2:41][n:32]2[n:33][cH:34][c:35]3[cH:36][cH:37][cH:38][cH:39][c:40]23)[CH3:44])[cH:22][c:23]([NH:26][C:27]([CH3:28])=[O:29])[cH:24][cH:25]1)=[O:31]Participants
7
Sources & evidence
- ORD record
- ord-5297dd071e7f463d810e81b1950441c9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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