Acetic Acid → HCID 12598343, compound

Reaction equation

[BH4-:23].[CH2:1]([CH3:2])[C:3]12[C:4](=[O:22])[CH2:5][CH2:6][CH:7]1[C:8]1=[C:9]([CH2:10][CH2:11]2)[c:12]2[cH:13][cH:14][c:15]([O:20][CH3:21])[cH:16][c:17]2[CH2:18][CH2:19]1.[CH3:25][C:26](=[O:27])[OH:28].[CH3:29][OH:30].[Na+:24]>>[CH2:1]([CH3:2])[C:3]12[CH:4]([OH:22])[CH2:5][CH2:6][CH:7]1[C:8]1=[C:9]([CH2:10][CH2:11]2)[c:12]2[cH:13][cH:14][c:15]([O:20][CH3:21])[cH:16][c:17]2[CH2:18][CH2:19]1

Participants

Reactant 5

HCID 176Acetic Acid

HCID 887Methanol

HCID 923Sodium Ion

HCID 28123Borohydride

HCID 21485682HCID 21485682, compound

Product 1

HCID 12598343HCID 12598343, compound

Sources & evidence

ORD record: ord-706e1a901efb431281befa083ffb3168
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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