Toluene → HCID 178515359, compound

HRID 214296Notes

Reaction equation

HRID 214296 reaction equation
[CH3:36][CH:37]([CH2:38][AlH:39][CH2:40][CH:41]([CH3:42])[CH3:43])[CH3:44].[CH3:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[s:1]1[c:2]2[c:3]([cH:4][c:5]1[CH:6]([CH:7]=[CH:8][CH:9]1[CH:10]([O:18][CH:19]3[O:20][CH2:21][CH2:22][CH2:23][CH2:24]3)[CH2:11][CH:12]3[O:13][C:14](=[O:17])[CH2:15][CH:16]13)[O:25][CH:26]1[O:27][CH2:28][CH2:29][CH2:30][CH2:31]1)[cH:32][cH:33][cH:34][cH:35]2>>[s:1]1[c:2]2[c:3]([cH:4][c:5]1[CH:6]([CH:7]=[CH:8][CH:9]1[CH:10]([O:18][CH:19]3[O:20][CH2:21][CH2:22][CH2:23][CH2:24]3)[CH2:11][CH:12]3[O:13][CH:14]([OH:17])[CH2:15][CH:16]13)[O:25][CH:26]1[O:27][CH2:28][CH2:29][CH2:30][CH2:31]1)[cH:32][cH:33][cH:34][cH:35]2

Participants

4

Sources & evidence

ORD record
ord-69f05f816b2e4777b7ee8213cf87bb43
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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