Hydrochloric Acid → PPAR(alpha)-MO-1

HRID 1233616Notes

Reaction equation

HRID 1233616 reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH2:6][c:7]1[cH:8][cH:9][c:10]([O:13][CH2:14][C:15](=[O:16])[N:17]([CH2:18][CH2:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH3:31])[cH:11][cH:12]1)[O:32][CH2:33][CH3:34])=[O:35].[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[ClH:38].[Li+:37].[OH-:36]>>[O:3]=[C:4]([CH:5]([CH2:6][c:7]1[cH:8][cH:9][c:10]([O:13][CH2:14][C:15](=[O:16])[N:17]([CH2:18][CH2:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH3:31])[cH:11][cH:12]1)[O:32][CH2:33][CH3:34])[OH:35]

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 961HydroxideHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 178444772ethyl 2-ethoxy-3-[4-[2-[hexyl(2-phenylethyl)amino]-2-oxoethoxy]phenyl]propanoate

Product 1

HCID 17979035PPAR(alpha)-MO-1

Sources & evidence

ORD record
ord-73fc82aa346e44aa91e2ca7fc04670af
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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