Ethanol → HCID 67133513, compound

HRID 1146263Notes

Reaction equation

HRID 1146263 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([C:17]2([C:20](=[O:21])[NH:22][c:23]3[n:24][c:25](-[c:29]4[cH:30][cH:31][c:32]([S:35](=[O:36])(=[O:37])[N:38]5[CH:39]([CH2:43][OH:44])[CH2:40][CH2:41][CH2:42]5)[cH:33][cH:34]4)[cH:26][cH:27][cH:28]3)[CH2:18][CH2:19]2)[cH:12][cH:13][c:14]1[O:15][CH3:16].[CH3:47][CH2:48][OH:49].[H:45][H:46]>>[OH:8][c:9]1[cH:10][c:11]([C:17]2([C:20](=[O:21])[NH:22][c:23]3[n:24][c:25](-[c:29]4[cH:30][cH:31][c:32]([S:35](=[O:36])(=[O:37])[N:38]5[CH:39]([CH2:43][OH:44])[CH2:40][CH2:41][CH2:42]5)[cH:33][cH:34]4)[cH:26][cH:27][cH:28]3)[CH2:18][CH2:19]2)[cH:12][cH:13][c:14]1[O:15][CH3:16]

Participants

4

Reactant 3

HCID 702EthanolHCID 67133985HCID 67133985, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 67133513HCID 67133513, compound

Sources & evidence

ORD record
ord-41c8defac42d4d56aba6ccdee50e989b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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