Acetic Acid → HCID 70573560, compound

HRID 1121803Notes

Reaction equation

HRID 1121803 reaction equation
[BH4-:33].[CH3:35][C:36](=[O:37])[OH:38].[CH3:39][OH:40].[CH:25](=[O:26])[c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[NH2:2][c:3]1[cH:4][c:5]([CH2:6][CH:7]=[CH:8][CH2:9][NH2:10])[cH:11][c:12]([S:21]([NH2:22])(=[O:23])=[O:24])[c:13]1[O:14][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1.[Na+:34].[OH2:1].[OH2:41]>>[NH:2]([c:3]1[cH:4][c:5]([CH2:6][CH:7]=[CH:8][CH2:9][NH2:10])[cH:11][c:12]([S:21]([NH2:22])(=[O:23])=[O:24])[c:13]1[O:14][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)[CH2:25][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 240BenzaldehydeHCID 887MethanolHCID 923Sodium ionHCID 962Water2×HCID 28123BorohydrideHCID 70574274HCID 70574274, compound

Product 1

HCID 70573560HCID 70573560, compound

Sources & evidence

ORD record
ord-f487fc1a30fb4b65abf5e727263494e6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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