Citric Acid → HCID 178473638, compound

HRID 2323332Notes

Reaction equation

HRID 2323332 reaction equation
[C:41]([OH:42])(=[O:43])[CH2:44][C:45]([CH2:46][C:47]([OH:48])=[O:49])([C:50]([OH:51])=[O:52])[OH:53].[CH3:55][c:56]1[cH:57][c:58]([CH3:59])[cH:60][c:61]([CH3:62])[n:63]1.[CH:1]1([CH2:4][n:5]2[n:6][c:7]([O:22][CH:23]3[CH:24]([OH:25])[CH:26]([OH:27])[CH:28]([OH:29])[CH:30]([CH2:32][OH:33])[O:31]3)[c:8]([CH2:11][c:12]3[cH:13][cH:14][c:15]([O:18][CH:19]([CH3:20])[CH3:21])[cH:16][cH:17]3)[c:9]2[CH3:10])[CH2:2][CH2:3]1.[Cl:34][C:35](=[O:36])[O:37][CH2:38][CH3:39].[OH2:40].[OH2:54]>>[CH:1]1([CH2:4][n:5]2[n:6][c:7]([O:22][CH:23]3[CH:24]([OH:25])[CH:26]([OH:27])[CH:28]([OH:29])[CH:30]([CH2:32][O:33][C:35](=[O:36])[O:37][CH2:38][CH3:39])[O:31]3)[c:8]([CH2:11][c:12]3[cH:13][cH:14][c:15]([O:18][CH:19]([CH3:20])[CH3:21])[cH:16][cH:17]3)[c:9]2[CH3:10])[CH2:2][CH2:3]1

Participants

6

Reactant 5

HCID 311Citric AcidHCID 962Water2×HCID 79532,4,6-TrimethylpyridineHCID 10928Ethyl chloroformateHCID 178422727HCID 178422727, compound

Product 1

HCID 178473638HCID 178473638, compound

Sources & evidence

ORD record
ord-e392832baa18467084c4b10dc316c5d0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…