Ethanol → HCID 10836335, compound

HRID 194591Notes

Reaction equation

HRID 194591 reaction equation
[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[CH3:37][CH2:38][OH:39].[F:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH2:7][CH3:8])[cH:9][cH:10][c:11]([NH:13][C:14](=[O:15])[c:16]2[cH:17][c:18]3[c:23]([cH:24][cH:25]2)[C:22]([CH3:26])([CH3:27])[CH2:21][CH:20]=[C:19]3[c:28]2[cH:29][cH:30][c:31]([CH3:34])[cH:32][cH:33]2)[cH:12]1.[Na+:36].[OH-:35]>>[F:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:9][cH:10][c:11]([NH:13][C:14](=[O:15])[c:16]2[cH:17][c:18]3[c:23]([cH:24][cH:25]2)[C:22]([CH3:26])([CH3:27])[CH2:21][CH:20]=[C:19]3[c:28]2[cH:29][cH:30][c:31]([CH3:34])[cH:32][cH:33]2)[cH:12]1

Participants

6

Sources & evidence

ORD record
ord-ee11007f2dd94622bcdb981151bc583c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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