Pyridine → Benzoate

HRID 86631

Reaction equation

HRID 86631 reaction equation
[CH3:1][C:2]([OH:3])([CH2:4][OH:5])[CH:6]([OH:7])[C:8]12[NH:9][C:10](=[O:11])[C:12]([OH:13])([NH:14][C:15]1=[O:16])[C:17](=[CH2:18])[CH2:19][CH2:20][O:21]2.[CH3:45][N:46]([CH3:47])[c:48]1[cH:49][cH:50][n:51][cH:52][cH:53]1.[O:22]=[C:23]([O:24][C:25]([c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)=[O:32])[c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[cH:39]1[cH:40][cH:41][n:42][cH:43][cH:44]1>>[CH3:1][C:2]([OH:3])([CH2:4][OH:5])[CH:6]([OH:7])[C:8]12[NH:9][C:10](=[O:11])[C:12]([OH:13])([NH:14][C:15]1=[O:16])[C:17](=[CH2:18])[CH2:19][CH2:20][O:21]2.[O:22]=[C:23]([O-:24])[c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1

Participants

6

Reactant 4

HCID 1049PyridineHCID 7167Benzoic anhydrideHCID 142844-(Dimethylamino)pyridineHCID 4260586-Hydroxy-5-methylene-1-(1,2,3-trihydroxy-2-methylpropyl)-2-oxa-7,9-diazabicyclo[4.2.2]decane-8,10-dione

Product 2

HCID 242BenzoateHCID 4260586-Hydroxy-5-methylene-1-(1,2,3-trihydroxy-2-methylpropyl)-2-oxa-7,9-diazabicyclo[4.2.2]decane-8,10-dione

Sources & evidence

ORD record
ord-fffe7b3d091b4bb5b97b3d2211a9776d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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