Acetic Acid → HCID 20438213, compound

HRID 668835Notes

Reaction equation

HRID 668835 reaction equation
[BH4-:39].[C:1]([OH:2])(=[O:3])[CH3:4].[CH2:32]([c:33]1[cH:34][cH:35][cH:36][o:37]1)[NH2:38].[CH3:42][CH2:43][OH:44].[CH:5](=[O:6])[c:7]1[cH:8][c:9]([O:10][CH2:11][CH2:12][CH2:13][NH:14][c:15]2[n:16][c:17]([CH:21]([OH:22])[c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[n:18][n:19]2[CH3:20])[cH:29][cH:30][cH:31]1.[Na+:40].[OH2:41]>>[CH2:5]([c:7]1[cH:8][c:9]([O:10][CH2:11][CH2:12][CH2:13][NH:14][c:15]2[n:16][c:17]([CH:21]([OH:22])[c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[n:18][n:19]2[CH3:20])[cH:29][cH:30][cH:31]1)[NH:38][CH2:32][c:33]1[cH:34][cH:35][cH:36][o:37]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 702EthanolHCID 923Sodium ionHCID 962WaterHCID 3438FurfurylamineHCID 28123BorohydrideHCID 86739759HCID 86739759, compound

Product 1

HCID 20438213HCID 20438213, compound

Sources & evidence

ORD record
ord-02c59adce3d246029e1b87248c99524e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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