Citric Acid → HCID 25026779, compound

HRID 1212688Notes

Reaction equation

HRID 1212688 reaction equation
[C:1]([OH:2])(=[O:3])[CH2:4][C:5]([CH2:6][C:7]([OH:8])=[O:9])([C:10]([OH:11])=[O:12])[OH:13].[CH3:55][OH:56].[F:14][c:15]1[cH:16][c:17]2[c:18]3[c:19]([nH:20][c:21]2[cH:22][cH:23]1)[C:24]1([CH2:25][CH2:26][C:27]([NH:30][CH2:31][c:32]2[cH:33][cH:34][c:35]([O:36][CH3:37])[cH:38][cH:39]2)([CH2:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[CH2:28][CH2:29]1)[O:47][CH2:48][CH2:49]3.[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1>>[F:14][c:15]1[cH:16][c:17]2[c:18]3[c:19]([nH:20][c:21]2[cH:22][cH:23]1)[C:24]1([CH2:25][CH2:26][C:27]([NH2:30])([CH2:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[CH2:28][CH2:29]1)[O:47][CH2:48][CH2:49]3

Participants

5

Reactant 4

HCID 311Citric AcidHCID 887MethanolHCID 8028TetrahydrofuranHCID 67127512HCID 67127512, compound

Product 1

HCID 25026779HCID 25026779, compound

Sources & evidence

ORD record
ord-84a2a21b9fbc40d1ae1877a4735378d0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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