Water → HCID 178445422, compound

HRID 1544209Notes

Reaction equation

HRID 1544209 reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][CH:5]1[CH2:6][CH:7]2[CH2:8][CH2:9][C:10]3=[C:11]4[CH2:12][CH2:13][CH:14]([CH:15]([CH2:16][CH:17]=[CH2:18])[CH3:19])[C:20]4([CH3:36])[CH:21]([O:28][C:29]([C:30]([CH2:31][CH3:32])([CH3:33])[CH3:34])=[O:35])[CH2:22][CH:23]3[C:24]2([CH3:27])[CH2:25][CH2:26]1.[C:37]([OH:38])([CH3:39])([CH3:40])[CH3:41].[CH3:44][N+:45]1([O-:46])[CH2:47][CH2:48][O:49][CH2:50][CH2:51]1.[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[OH2:42].[OH2:43]>>[C:1]([CH3:2])(=[O:3])[O:4][CH:5]1[CH2:6][CH:7]2[CH2:8][CH2:9][C:10]3=[C:11]4[CH2:12][CH2:13][CH:14]([CH:15]([CH2:16][CH:17]([CH2:18][OH:42])[OH:43])[CH3:19])[C:20]4([CH3:36])[CH:21]([O:28][C:29]([C:30]([CH2:31][CH3:32])([CH3:33])[CH3:34])=[O:35])[CH2:22][CH:23]3[C:24]2([CH3:27])[CH2:25][CH2:26]1

Participants

6

Reactant 5

HCID 962Water2×HCID 6386tert-ButanolHCID 8857Ethyl AcetateHCID 82029Methyl morpholine oxideHCID 178442054HCID 178442054, compound

Product 1

HCID 178445422HCID 178445422, compound

Sources & evidence

ORD record
ord-0129ff4e15e44427b52d2fbf882c89df
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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