Acetic Acid → HCID 13338606, compound

HRID 141829Notes

Reaction equation

HRID 141829 reaction equation
[BH4-:21].[CH3:15][CH2:16][C:17]([CH2:18][CH3:19])=[O:20].[CH3:25][C:26](=[O:27])[OH:28].[N:1]1=[C:6]2[N:5]([CH2:4][CH2:3][CH2:2]1)[c:9]1[c:8]([cH:13][cH:12][c:11]([NH2:14])[cH:10]1)[S:7]2.[NH4+:23].[Na+:22].[OH-:24]>>[N:1]1=[C:6]2[N:5]([CH2:4][CH2:3][CH2:2]1)[c:9]1[c:8]([cH:13][cH:12][c:11]([NH:14][CH:17]([CH2:16][CH3:15])[CH2:18][CH3:19])[cH:10]1)[S:7]2

Participants

8

Sources & evidence

ORD record
ord-f8e0dc099c1349b39189302d8bcdfba5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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