Acetate → HCID 18442911, compound

HRID 2338793Notes

Reaction equation

HRID 2338793 reaction equation
[C:27]([CH2:28][C:29](=[O:30])[O:31][CH3:32])(=[O:33])[O:34][CH3:35].[C:36]([O-:37])(=[O:38])[CH3:39].[CH3:1][C:2]1([CH3:26])[c:3]2[cH:4][cH:5][c:6]([O:14][CH2:15][CH2:16][O:17][c:18]3[cH:19][cH:20][c:21]([CH:22]=[O:23])[cH:24][cH:25]3)[cH:7][c:8]2[C:9]([CH3:12])([CH3:13])[CH2:10][CH2:11]1.[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[NH2+:40]1[CH2:41][CH2:42][CH2:43][CH2:44][CH2:45]1>>[CH3:1][C:2]1([CH3:26])[c:3]2[cH:4][cH:5][c:6]([O:14][CH2:15][CH2:16][O:17][c:18]3[cH:19][cH:20][c:21]([CH:22]=[C:28]([C:27](=[O:33])[O:34][CH3:35])[C:29](=[O:30])[O:31][CH3:32])[cH:24][cH:25]3)[cH:7][c:8]2[C:9]([CH3:12])([CH3:13])[CH2:10][CH2:11]1

Participants

6

Reactant 5

HCID 175AcetateHCID 1140TolueneHCID 7943Dimethyl malonateHCID 6379691-PiperidiniumHCID 18442907HCID 18442907, compound

Product 1

HCID 18442911HCID 18442911, compound

Sources & evidence

ORD record
ord-8a5fdb9e35c040809c11456b09b0424c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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