Citric Acid → HCID 178473279, compound

HRID 1565947Notes

Reaction equation

HRID 1565947 reaction equation
[Br:49][CH2:50][CH2:51][OH:52].[C:43](=[O:44])([O-:45])[O-:46].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH:7]([CH2:41][CH3:42])[CH2:8][CH:9]([NH:18][c:19]2[n:20][cH:21][c:22]([OH:40])[c:23]([CH2:25][c:26]3[cH:27][c:28]([C:36]([F:37])([F:38])[F:39])[cH:29][c:30]([C:32]([F:33])([F:34])[F:35])[cH:31]3)[n:24]2)[c:10]2[n:11][c:12]([O:16][CH3:17])[cH:13][cH:14][c:15]21.[CH3:66][N:67]([CH3:68])[CH:69]=[O:70].[K+:47].[K+:48].[OH:53][C:54]([CH2:55][C:56]([C:57](=[O:58])[OH:59])([CH2:60][C:61](=[O:62])[OH:63])[OH:64])=[O:65]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH:7]([CH2:41][CH3:42])[CH2:8][CH:9]([NH:18][c:19]2[n:20][cH:21][c:22]([O:40][CH2:50][CH2:51][OH:52])[c:23]([CH2:25][c:26]3[cH:27][c:28]([C:36]([F:37])([F:38])[F:39])[cH:29][c:30]([C:32]([F:33])([F:34])[F:35])[cH:31]3)[n:24]2)[c:10]2[n:11][c:12]([O:16][CH3:17])[cH:13][cH:14][c:15]21

Participants

7

Reactant 6

HCID 311Citric AcidHCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 108982-BromoethanolHCID 19660Carbonate IonHCID 142684723HCID 142684723, compound

Product 1

HCID 178473279HCID 178473279, compound

Sources & evidence

ORD record
ord-608b31321c6f49cb8c11614521b93ca0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…