Citric Acid → HCID 15161043, compound

HRID 316727Notes

Reaction equation

HRID 316727 reaction equation
[Br:12][CH2:13][CH2:14][CH2:15][c:16]1[cH:17][c:18]2[c:19]([cH:31][c:32]1[O:33][CH2:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)[CH2:20][CH:21]([CH2:23][CH2:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[O:22]2.[CH3:54][N:55]([CH3:56])[CH:57]=[O:58].[H-:10].[Na+:11].[OH:1][c:2]1[cH:3][cH:4][c:5]([C:8]#[N:9])[cH:6][cH:7]1.[OH:41][C:42]([CH2:43][C:44]([C:45](=[O:46])[OH:47])([CH2:48][C:49](=[O:50])[OH:51])[OH:52])=[O:53]>>[O:1]([c:2]1[cH:3][cH:4][c:5]([C:8]#[N:9])[cH:6][cH:7]1)[CH2:13][CH2:14][CH2:15][c:16]1[cH:17][c:18]2[c:19]([cH:31][c:32]1[O:33][CH2:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)[CH2:20][CH:21]([CH2:23][CH2:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[O:22]2

Participants

7

Reactant 6

HCID 311Citric AcidHCID 923Sodium ionHCID 6228DimethylformamideHCID 130194-CyanophenolHCID 166653HydrideHCID 15161041HCID 15161041, compound

Product 1

HCID 15161043HCID 15161043, compound

Sources & evidence

ORD record
ord-b446ee31324e48d187df6bd3c1b7f127
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…