Ethanol → HCID 178497077, compound

HRID 1143629Notes

Reaction equation

HRID 1143629 reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][CH:5]1[CH:6]([OH:35])[CH2:7][CH:8]2[CH2:9][CH2:10][CH:11]3[CH:12]4[CH2:13][CH2:14][CH:15]([C:31](=[O:32])[O:33][CH3:34])[C:16]4([CH3:17])[CH2:18][CH:19]([NH:24][CH:25]4[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]4)[CH:20]3[C:21]2([CH3:23])[CH2:22]1.[CH3:36][c:37]1[cH:38][cH:39][c:40]([S:41]([OH:42])(=[O:43])=[O:44])[cH:45][cH:46]1.[CH3:47][C:48](=[O:49])[O:50][C:51](=[O:52])[CH3:53].[CH3:58][CH2:59][OH:60].[CH3:61][CH2:62][O:63][C:64](=[O:65])[CH3:66].[CH:54]([Cl:55])([Cl:56])[Cl:57]>>[C:1]([CH3:2])(=[O:3])[O:4][CH:5]1[CH:6]([O:35][C:48]([CH3:47])=[O:49])[CH2:7][CH:8]2[CH2:9][CH2:10][CH:11]3[CH:12]4[CH2:13][CH2:14][CH:15]([C:31](=[O:32])[O:33][CH3:34])[C:16]4([CH3:17])[CH2:18][CH:19]([NH:24][CH:25]4[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]4)[CH:20]3[C:21]2([CH3:23])[CH2:22]1

Participants

7

Reactant 6

HCID 702EthanolHCID 6101p-Toluenesulfonic acidHCID 6212ChloroformHCID 7918Acetic AnhydrideHCID 8857Ethyl AcetateHCID 178497084HCID 178497084, compound

Product 1

HCID 178497077HCID 178497077, compound

Sources & evidence

ORD record
ord-5edc5f17489d43f18b4bae6c0372c47e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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