Citric Acid → Ethyl [3,4,5-trihydroxy-6-[2-[(4-methoxyphenyl)methyl]phenoxy]oxan-2-yl]methyl carbonate

HRID 104623Notes

Reaction equation

HRID 104623 reaction equation
[CH3:47][c:48]1[cH:49][c:50]([CH3:51])[cH:52][c:53]([CH3:54])[n:55]1.[Cl:28][C:29](=[O:30])[O:31][CH2:32][CH3:33].[O:1]([CH:2]1[CH:3]([OH:4])[CH:5]([OH:6])[CH:7]([OH:8])[CH:9]([CH2:11][OH:12])[O:10]1)[c:13]1[c:14]([CH2:19][c:20]2[cH:21][cH:22][c:23]([O:26][CH3:27])[cH:24][cH:25]2)[cH:15][cH:16][cH:17][cH:18]1.[OH:34][C:35]([CH2:36][C:37]([C:38](=[O:39])[OH:40])([CH2:41][C:42](=[O:43])[OH:44])[OH:45])=[O:46]>>[O:1]([CH:2]1[CH:3]([OH:4])[CH:5]([OH:6])[CH:7]([OH:8])[CH:9]([CH2:11][O:12][C:29](=[O:30])[O:31][CH2:32][CH3:33])[O:10]1)[c:13]1[c:14]([CH2:19][c:20]2[cH:21][cH:22][c:23]([O:26][CH3:27])[cH:24][cH:25]2)[cH:15][cH:16][cH:17][cH:18]1

Participants

5

Reactant 4

HCID 311Citric AcidHCID 79532,4,6-TrimethylpyridineHCID 10928Ethyl chloroformateHCID 221459522-Hydroxymethyl-6-[2-(4-methoxy-benzyl)-phenoxy]-tetrahydro-pyran-3,4,5-triol

Product 1

HCID 22506569Ethyl [3,4,5-trihydroxy-6-[2-[(4-methoxyphenyl)methyl]phenoxy]oxan-2-yl]methyl carbonate

Sources & evidence

ORD record
ord-4cf6c8b0c2ca4b2d8bb807a3ff9db983
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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