Ethanol → HCID 22261864, compound

HRID 160758Notes

Reaction equation

HRID 160758 reaction equation
[CH3:39][CH2:40][OH:41].[Cl:1][c:2]1[c:3]([CH2:35][CH3:36])[cH:4][c:5]([O:8][c:9]2[cH:10][cH:11][c:12]([CH:15]3[CH:16]([CH2:21][c:22]4[cH:23][c:24]([O:28][C:29]([CH:30]([F:31])[F:32])([F:33])[F:34])[cH:25][cH:26][cH:27]4)[NH:17][C:18](=[O:20])[O:19]3)[cH:13][cH:14]2)[cH:6][cH:7]1.[Na+:38].[OH-:37]>>[Cl:1][c:2]1[c:3]([CH2:35][CH3:36])[cH:4][c:5]([O:8][c:9]2[cH:10][cH:11][c:12]([CH:15]([CH:16]([NH2:17])[CH2:21][c:22]3[cH:23][c:24]([O:28][C:29]([CH:30]([F:31])[F:32])([F:33])[F:34])[cH:25][cH:26][cH:27]3)[OH:19])[cH:13][cH:14]2)[cH:6][cH:7]1

Participants

5

Sources & evidence

ORD record
ord-ed02582fa47345d2ae8c16074ef966e5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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