Acetic Acid → HCID 69156905, compound

HRID 1127322Notes

Reaction equation

HRID 1127322 reaction equation
[C:15]([CH3:16])([CH3:17])([CH3:18])[O:19][C:20](=[O:21])[N:22]1[CH2:23][CH2:24][C:25](=[O:28])[CH2:26][CH2:27]1.[C:29]([O:30][BH-:31]([O:32][C:33](=[O:34])[CH3:35])[O:36][C:37](=[O:38])[CH3:39])(=[O:40])[CH3:41].[CH3:43][C:44](=[O:45])[OH:46].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:9][CH:10]([O:11][CH3:12])[O:13][CH3:14])[c:6]([NH2:8])[cH:7]1.[Na+:42]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:9][CH:10]([O:11][CH3:12])[O:13][CH3:14])[c:6]([NH:8][CH:25]2[CH2:24][CH2:23][N:22]([C:20]([O:19][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:21])[CH2:27][CH2:26]2)[cH:7]1

Participants

6

Sources & evidence

ORD record
ord-2219d7c00a7141c09e5c29f6df7fb20a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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