Benzene → HCID 21849167, compound

HRID 2326271Notes

Reaction equation

HRID 2326271 reaction equation
[C:1]([CH3:2])(=[O:3])[NH:4][C:5]([CH2:6][OH:7])([CH2:8][OH:9])[c:10]1[cH:11][cH:12][c:13]([CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH3:25])[cH:14][cH:15]1.[CH3:26][O:27][C:28]([CH3:29])([CH3:30])[O:31][CH3:32].[c:33]1([CH3:34])[c:35]([S:36]([OH:37])(=[O:38])=[O:39])[cH:40][cH:41][cH:42][cH:43]1.[cH:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1>>[C:1]([CH3:2])(=[O:3])[NH:4][C:5]1([c:10]2[cH:11][cH:12][c:13]([CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH3:25])[cH:14][cH:15]2)[CH2:6][O:7][C:28]([CH3:29])([CH3:30])[O:9][CH2:8]1

Participants

5

Sources & evidence

ORD record
ord-48a8747807de4ee89ead5befdb2d9c17
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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