Acetic Acid → Acetic Acid

HRID 1130940Notes

Reaction equation

HRID 1130940 reaction equation
[BH4-:48].[C:1]([CH3:2])(=[O:3])[OH:4].[C:5]([CH3:6])(=[O:7])[OH:8].[CH3:50][OH:51].[NH2:9][c:10]1[c:11]2[c:12]([n:13][cH:14][n:15]1)[n:16]([CH:35]1[CH2:36][CH2:37][CH:38]([N:41]3[CH2:42][CH2:43][N:44]([CH3:47])[CH2:45][CH2:46]3)[CH2:39][CH2:40]1)[n:17][c:18]2-[c:19]1[cH:20][cH:21][c:22]([NH:23][CH2:24][C:25](=[O:26])[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:33][cH:34]1.[Na+:49]>>[C:1]([CH3:2])(=[O:3])[OH:4].[C:5]([CH3:6])(=[O:7])[OH:8].[NH2:9][c:10]1[c:11]2[c:12]([n:13][cH:14][n:15]1)[n:16]([CH:35]1[CH2:36][CH2:37][CH:38]([N:41]3[CH2:42][CH2:43][N:44]([CH3:47])[CH2:45][CH2:46]3)[CH2:39][CH2:40]1)[n:17][c:18]2-[c:19]1[cH:20][cH:21][c:22]([NH:23][CH2:24][CH:25]([OH:26])[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:33][cH:34]1

Participants

7

Reactant 5

HCID 176Acetic Acid2×HCID 887MethanolHCID 923Sodium ionHCID 28123BorohydrideHCID 20816985HCID 20816985, compound

Product 2

HCID 176Acetic Acid2×HCID 20816984HCID 20816984, compound

Sources & evidence

ORD record
ord-c350eabac2e74f5e828625a1696ac025
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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