Ethanol → HCID 178468571, compound

HRID 308394Notes

Reaction equation

HRID 308394 reaction equation
[CH2:1]([CH3:2])[O:3][CH:4]1[CH:5]([OH:34])[CH2:6][CH:7]2[CH2:8][CH2:9][CH:10]3[CH:11]4[CH2:12][CH2:13][CH:14]([C:29](=[O:30])[O:31][CH2:32][CH3:33])[C:15]4([CH3:16])[CH2:17][CH:18]([NH:23][CH2:24][CH2:25][CH:26]([CH3:27])[CH3:28])[CH:19]3[C:20]2([CH3:22])[CH2:21]1.[CH3:35][c:36]1[cH:37][cH:38][c:39]([S:40](=[O:41])(=[O:42])[OH:43])[cH:44][cH:45]1.[CH3:46][C:47](=[O:48])[O:49][C:50](=[O:51])[CH3:52].[CH3:57][CH2:58][OH:59].[CH:53]([Cl:54])([Cl:55])[Cl:56]>>[CH2:1]([CH3:2])[O:3][CH:4]1[CH:5]([O:34][C:47]([CH3:46])=[O:48])[CH2:6][CH:7]2[CH2:8][CH2:9][CH:10]3[CH:11]4[CH2:12][CH2:13][CH:14]([C:29](=[O:30])[O:31][CH2:32][CH3:33])[C:15]4([CH3:16])[CH2:17][CH:18]([NH:23][CH2:24][CH2:25][CH:26]([CH3:27])[CH3:28])[CH:19]3[C:20]2([CH3:22])[CH2:21]1

Participants

6

Sources & evidence

ORD record
ord-463f957a0da64154b843fd12e9a4578a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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