CID 406 → [4-[4-(m-Tolyl)-3-oxo-pent-1-enyl]-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] benzoate

HRID 192815

Reaction equation

HRID 192815 reaction equation
[CH3:45][O:46][CH2:47][CH2:48][O:49][CH3:50].[CH:25](=[O:26])[CH:27]1[CH:28]2[CH2:29][C:30](=[O:44])[O:31][CH:32]2[CH2:33][CH:34]1[O:35][C:36]([c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)=[O:43].[H-:1].[Na+:2].[O:7]=[C:8]([CH2:9][P:10](=[O:11])([O:12][CH3:13])[O:14][CH3:15])[CH:16]([CH3:17])[c:18]1[cH:19][c:20]([CH3:24])[cH:21][cH:22][cH:23]1.[PH:3](=[O:4])([O-:5])[O-:6]>>[O:7]=[C:8]([CH:9]=[CH:25][CH:27]1[CH:28]2[CH2:29][C:30](=[O:44])[O:31][CH:32]2[CH2:33][CH:34]1[O:35][C:36]([c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)=[O:43])[CH:16]([CH3:17])[c:18]1[cH:19][c:20]([CH3:24])[cH:21][cH:22][cH:23]1

Participants

7

Reactant 6

HCID 406CID 406HCID 923Sodium ionHCID 80711,2-DimethoxyethaneHCID 166653HydrideHCID 3368300(4-Formyl-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl) benzoateHCID 872717271-Dimethoxyphosphoryl-3-(3-methylphenyl)butan-2-one

Product 1

HCID 77279631[4-[4-(m-Tolyl)-3-oxo-pent-1-enyl]-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] benzoate

Sources & evidence

ORD record
ord-fda75a4b6de94bd987e1c9839234cde7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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