Acetic Acid → HCID 23156793, compound

HRID 2142300Notes

Reaction equation

HRID 2142300 reaction equation
[C:35](=[O:36])([OH:37])[O-:38].[C:5]([BH3-:6])#[N:7].[CH3:1][C:2](=[O:3])[OH:4].[CH3:40][OH:41].[Na+:39].[Na+:8].[O:9]1[CH2:10][CH2:11][N:12]([CH2:15][CH2:16][NH:17][c:18]2[cH:19][cH:20][c:21]3[cH:22][c:23](-[c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)[nH:24][c:25](=[O:28])[c:26]3[cH:27]2)[CH2:13][CH2:14]1>>[CH3:1][N:17]([CH2:16][CH2:15][N:12]1[CH2:11][CH2:10][O:9][CH2:14][CH2:13]1)[c:18]1[cH:19][cH:20][c:21]2[cH:22][c:23](-[c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[nH:24][c:25](=[O:28])[c:26]2[cH:27]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium ion2×HCID 498716Cyano-borohydrideHCID 23156857HCID 23156857, compound

Product 1

HCID 23156793HCID 23156793, compound

Sources & evidence

ORD record
ord-d1b5dd78e2d34e13897c9f7eb715f251
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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