3,4-Dimethylphenol → 8-Hydroxy-8-(6-hydroxy-2,3-dihydro-1-benzofuran-5-yl)-6-(oxolan-2-ylmethyl)-2,3-dihydro-[1,4]dioxino[2,3-f]indol-7-one

HRID 2125531Notes

Reaction equation

HRID 2125531 reaction equation
[CH3:11][c:12]1[c:13]([CH3:14])[cH:15][c:16]([OH:17])[cH:18][cH:19]1.[O:1]1[CH2:2][CH2:3][c:4]2[c:5]1[cH:6][c:7]([OH:10])[cH:8][cH:9]2.[O:20]1[CH:21]([CH2:25][N:26]2[C:27](=[O:40])[C:28](=[O:39])[c:29]3[cH:30][c:31]4[c:32]([cH:33][c:34]32)[O:35][CH2:36][CH2:37][O:38]4)[CH2:22][CH2:23][CH2:24]1.[c:41]1([CH:42]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[N:49]2[c:50]3[c:51]([cH:52][cH:53][cH:54][cH:55]3)[C:56](=[O:57])[C:58]2=[O:59])[cH:60][cH:61][cH:62][cH:63][cH:64]1>>[O:1]1[CH2:2][CH2:3][c:4]2[c:5]1[cH:6][c:7]([OH:10])[c:8]([C:28]1([OH:39])[C:27](=[O:40])[N:26]([CH2:25][CH:21]3[O:20][CH2:24][CH2:23][CH2:22]3)[c:34]3[c:29]1[cH:30][c:31]1[c:32]([cH:33]3)[O:35][CH2:36][CH2:37][O:38]1)[cH:9]2

Participants

5

Reactant 4

HCID 72493,4-DimethylphenolHCID 19692771-(diphenylmethyl)-1H-indole-2,3-dioneHCID 122365402,3-Dihydro-1-benzofuran-6-olHCID 178516910HCID 178516910, compound

Product 1

HCID 685981548-Hydroxy-8-(6-hydroxy-2,3-dihydro-1-benzofuran-5-yl)-6-(oxolan-2-ylmethyl)-2,3-dihydro-[1,4]dioxino[2,3-f]indol-7-one

Sources & evidence

ORD record
ord-16ba2f3e648d40bcaebe73aa55cfbe05
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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