N-[5-(2-amino-1-hydroxyethyl)-2-hydroxyphenyl]methanesulphonamide → HCID 178449598, compound
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[N:5]([c:6]1[cH:7][cH:8][c:9]([N:12]2[CH2:13][CH2:14][C:15](=[O:18])[CH2:16][CH2:17]2)[cH:10][cH:11]1)[C:19](=[O:20])[NH:21][CH2:22][C:23](=[O:24])[O:25][CH2:26][CH3:27].[NH2:28][CH2:29][CH:30]([OH:31])[c:32]1[cH:33][cH:34][c:35]([OH:43])[c:36]([NH:38][S:39](=[O:40])(=[O:41])[CH3:42])[cH:37]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[N:5]([c:6]1[cH:7][cH:8][c:9]([N:12]2[CH2:13][CH2:14][CH:15]([NH:28][CH2:29][CH:30]([OH:31])[c:32]3[cH:33][cH:34][c:35]([OH:43])[c:36]([NH:38][S:39](=[O:40])(=[O:41])[CH3:42])[cH:37]3)[CH2:16][CH2:17]2)[cH:10][cH:11]1)[C:19](=[O:20])[NH:21][CH2:22][C:23](=[O:24])[O:25][CH2:26][CH3:27]Participants
3
Sources & evidence
- ORD record
- ord-902ef7748d63425d9ba72f6bd4d56168
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
Loading…