Beta-Alanine → HCID 54311176, compound

HRID 94161Notes

Reaction equation

HRID 94161 reaction equation
[Cl:1][c:2]1[n:3][c:4]([NH:25][CH2:26][CH2:27][CH2:28][CH2:29][CH:30]2[CH2:31][C:32]([CH3:40])([CH3:41])[N:33]([O:38][CH3:39])[C:34]([CH3:36])([CH3:37])[CH2:35]2)[n:5][c:6]([NH:8][CH2:9][CH2:10][CH2:11][CH2:12][CH:13]2[CH2:14][C:15]([CH3:23])([CH3:24])[N:16]([O:21][CH3:22])[C:17]([CH3:19])([CH3:20])[CH2:18]2)[n:7]1.[NH2:42][CH2:43][CH2:44][C:45](=[O:46])[OH:47]>>[c:2]1([NH:42][CH2:43][CH2:44][C:45](=[O:46])[OH:47])[n:3][c:4]([NH:25][CH2:26][CH2:27][CH2:28][CH2:29][CH:30]2[CH2:31][C:32]([CH3:40])([CH3:41])[N:33]([O:38][CH3:39])[C:34]([CH3:36])([CH3:37])[CH2:35]2)[n:5][c:6]([NH:8][CH2:9][CH2:10][CH2:11][CH2:12][CH:13]2[CH2:14][C:15]([CH3:23])([CH3:24])[N:16]([O:21][CH3:22])[C:17]([CH3:19])([CH3:20])[CH2:18]2)[n:7]1

Participants

3

Sources & evidence

ORD record
ord-083838e9b917471aac3c8dd8a3426099
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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