2-Phenylbutyric Acid → HCID 75150467, compound

HRID 2349166Notes

Reaction equation

HRID 2349166 reaction equation
[CH2:17]([c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)[CH:24]([C:25](=[O:26])[OH:27])[C:28]([CH3:29])([CH3:30])[CH3:31].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH:10]2[CH:11]([CH2:12]1)[CH:13]([NH2:16])[CH2:14][CH2:15]2.[c:32]1([CH:33]([CH2:34][CH3:35])[C:36]([OH:37])=[O:38])[cH:39][cH:40][cH:41][cH:42][cH:43]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH:10]2[CH:11]([CH2:12]1)[CH:13]([NH:16][C:25]([CH:24]([CH2:17][c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)[C:28]([CH3:29])([CH3:30])[CH3:31])=[O:26])[CH2:14][CH2:15]2

Participants

4

Reactant 3

HCID 70122-Phenylbutyric AcidHCID 1842542-Benzyl-3,3-dimethylbutanoic acidHCID 426145342-Benzyl-octahydrocyclopenta[c]pyrrol-4-amine

Product 1

HCID 75150467HCID 75150467, compound

Sources & evidence

ORD record
ord-37488a25aa24401084b8ccd88654a1c4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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