Acetic Acid → HCID 178447426, compound

HRID 2133786Notes

Reaction equation

HRID 2133786 reaction equation
[BH4-:31].[C:33](=[O:34])([OH:35])[O-:36].[C:39]([OH:40])(=[O:41])[CH3:42].[CH3:29][OH:30].[Na+:32].[Na+:37].[OH2:38].[OH:1][CH2:2][C:3]12[CH2:4][CH2:5][C:6](=[O:28])[CH:7]=[C:8]1[CH:9]=[CH:10][C:11]1=[C:12]3[CH2:13][CH2:14][CH:15]([O:21][C:22]([C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27])[C:16]3([CH3:17])[CH2:18][CH2:19][CH:20]21>>[OH:1][CH2:2][C:3]12[CH2:4][CH2:5][CH:6]([OH:28])[CH:7]=[C:8]1[CH:9]=[CH:10][C:11]1=[C:12]3[CH2:13][CH2:14][CH:15]([O:21][C:22]([C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27])[C:16]3([CH3:17])[CH2:18][CH2:19][CH:20]21

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium ion2×HCID 962WaterHCID 28123BorohydrideHCID 178447425HCID 178447425, compound

Product 1

HCID 178447426HCID 178447426, compound

Sources & evidence

ORD record
ord-009379391e6c43058d37f21531c99bab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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