Benzene → HCID 9869915, compound

HRID 1545040Notes

Reaction equation

HRID 1545040 reaction equation
[CH3:38][C:39](=[O:40])[O:41][C:42](=[O:43])[CH3:44].[OH:1][c:2]1[c:3]([CH3:31])[c:4]2[c:9]([c:10]([CH3:13])[c:11]1[CH3:12])[O:8][C:7]([CH3:14])([CH2:15][O:16][c:17]1[cH:18][cH:19][c:20]([CH2:21][CH:22]3[C:23](=[O:28])[NH:24][C:25](=[O:27])[S:26]3)[cH:29][cH:30]1)[CH2:6][CH2:5]2.[cH:32]1[cH:33][cH:34][n:35][cH:36][cH:37]1.[cH:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1>>[O:1]([c:2]1[c:3]([CH3:31])[c:4]2[c:9]([c:10]([CH3:13])[c:11]1[CH3:12])[O:8][C:7]([CH3:14])([CH2:15][O:16][c:17]1[cH:18][cH:19][c:20]([CH2:21][CH:22]3[C:23](=[O:28])[NH:24][C:25](=[O:27])[S:26]3)[cH:29][cH:30]1)[CH2:6][CH2:5]2)[C:39]([CH3:38])=[O:40]

Participants

5

Sources & evidence

ORD record
ord-a6ee3358ddbd463cb32e0965e0c188fe
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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