Acetic Acid → HCID 178493415, compound

HRID 1571015Notes

Reaction equation

HRID 1571015 reaction equation
[C:41]([BH3-:42])#[N:43].[CH2:45]([N:46]([CH:47]([CH3:48])[CH3:49])[CH:50]([CH3:51])[CH3:52])[CH3:53].[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[NH:8][CH:9]2[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]2)[cH:15][c:16]([O:18][CH2:19][c:20]2[n:21][n:22][n:23][nH:24]2)[cH:17]1.[CH3:54][CH2:55][OH:56].[CH3:57][C:58](=[O:59])[OH:60].[CH:25]([CH3:26])([CH3:27])[O:28][c:29]1[cH:30][c:31]([CH:32]=[O:33])[cH:34][c:35]([O:37][CH:38]([CH3:39])[CH3:40])[cH:36]1.[Na+:44]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[NH:8][CH:9]2[CH2:10][CH2:11][N:12]([CH2:32][c:31]3[cH:30][c:29]([O:28][CH:25]([CH3:26])[CH3:27])[cH:36][c:35]([O:37][CH:38]([CH3:39])[CH3:40])[cH:34]3)[CH2:13][CH2:14]2)[cH:15][c:16]([O:18][CH2:19][c:20]2[nH:21][n:22][n:23][n:24]2)[cH:17]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 702EthanolHCID 923Sodium ionHCID 81531DiisopropylethylamineHCID 498716Cyano-borohydrideHCID 113106053,5-diisopropoxybenzaldehydeHCID 178493414HCID 178493414, compound

Product 1

HCID 178493415HCID 178493415, compound

Sources & evidence

ORD record
ord-55f2c61bd5c24dab92d55342a3181a89
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…