Citric Acid → HCID 57541944, compound

HRID 1214721Notes

Reaction equation

HRID 1214721 reaction equation
[CH3:1][c:2]1[c:3](-[c:12]2[cH:13][c:14]([CH2:15][O:16][c:17]3[cH:18][cH:19][c:20]([CH2:23][CH2:24][C:25](=[O:26])[O:27][CH3:28])[cH:21][cH:22]3)[cH:29][cH:30][cH:31]2)[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[cH:10][cH:11]1.[CH3:48][OH:49].[Na+:33].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1.[OH-:32].[OH2:34].[OH:35][C:36]([CH2:37][C:38]([C:39](=[O:40])[OH:41])([CH2:42][C:43](=[O:44])[OH:45])[OH:46])=[O:47]>>[CH3:1][c:2]1[c:3](-[c:12]2[cH:13][c:14]([CH2:15][O:16][c:17]3[cH:18][cH:19][c:20]([CH2:23][CH2:24][C:25](=[O:26])[OH:27])[cH:21][cH:22]3)[cH:29][cH:30][cH:31]2)[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[cH:10][cH:11]1

Participants

8

Sources & evidence

ORD record
ord-93468d26d32e422682f969170c03fbdf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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