Water → HCID 53976768, compound

HRID 311027Notes

Reaction equation

[CH3:32][C:33](=[O:34])[O:35][C:36](=[O:37])[CH3:38].[OH2:39].[OH:1][c:2]1[c:3]2[c:7]([c:8]([CH3:30])[c:9]([O:28][CH3:29])[c:10]1[CH2:11][CH:12]=[C:13]([CH2:14][CH2:15][C:16](=[O:17])[O:18][CH2:19][CH2:20][N:21]1[CH2:22][CH2:23][O:24][CH2:25][CH2:26]1)[CH3:27])[CH2:6][O:5][C:4]2=[O:31].[cH:40]1[cH:41][cH:42][n:43][cH:44][cH:45]1>>[O:1]([c:2]1[c:3]2[c:7]([c:8]([CH3:30])[c:9]([O:28][CH3:29])[c:10]1[CH2:11][CH:12]=[C:13]([CH2:14][CH2:15][C:16](=[O:17])[O:18][CH2:19][CH2:20][N:21]1[CH2:22][CH2:23][O:24][CH2:25][CH2:26]1)[CH3:27])[CH2:6][O:5][C:4]2=[O:31])[C:33]([CH3:32])=[O:34]

Participants

Reactant 4

HCID 962Water

HCID 1049Pyridine

HCID 42716-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid 2-(4-morpholinyl)ethyl ester

HCID 7918Acetic Anhydride

Product 1

HCID 53976768HCID 53976768, compound

Sources & evidence

ORD record: ord-9ca5cab235ac4d94ba4e035248db8eb8
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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