Acetic Acid → HCID 18785555, compound

HRID 163303Notes

Reaction equation

HRID 163303 reaction equation
[Br:1][c:2]1[c:3]([CH2:4][S:5][c:6]2[c:7]([NH2:8])[cH:9][cH:10][cH:11][cH:12]2)[cH:13][cH:14][cH:15][cH:16]1.[C:17]([CH3:18])([CH3:19])([CH3:20])[O:21][C:22](=[O:23])[N:24]1[CH2:25][CH2:26][C:27](=[O:30])[CH2:28][CH2:29]1.[C:31]([O:32][BH-:33]([O:34][C:35](=[O:36])[CH3:37])[O:38][C:39](=[O:40])[CH3:41])(=[O:42])[CH3:43].[CH3:45][C:46](=[O:47])[OH:48].[Na+:44]>>[Br:1][c:2]1[c:3]([CH2:4][S:5][c:6]2[c:7]([NH:8][CH:27]3[CH2:26][CH2:25][N:24]([C:22]([O:21][C:17]([CH3:18])([CH3:19])[CH3:20])=[O:23])[CH2:29][CH2:28]3)[cH:9][cH:10][cH:11][cH:12]2)[cH:13][cH:14][cH:15][cH:16]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 923Sodium ionHCID 735900tert-Butyl 4-oxopiperidine-1-carboxylateHCID 2724942TriacetoxyborohydrideHCID 11254872HCID 11254872, compound

Product 1

HCID 18785555HCID 18785555, compound

Sources & evidence

ORD record
ord-b753fd8660734819ac880debfb64aa92
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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