Acetic Acid → HCID 21064717, compound

HRID 2148950Notes

Reaction equation

HRID 2148950 reaction equation
[C:15]([CH3:16])([CH3:17])([CH3:18])[O:19][C:20](=[O:21])[N:22]1[CH2:23][CH2:24][C:25](=[O:28])[CH2:26][CH2:27]1.[C:29]([OH:30])(=[O:31])[CH3:32].[C:33]([O:34][BH-:35]([O:36][C:37](=[O:38])[CH3:39])[O:40][C:41](=[O:42])[CH3:43])(=[O:44])[CH3:45].[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[CH3:52][OH:53].[ClH:1].[ClH:2].[NH2:3][CH2:4][CH:5]([OH:6])[c:7]1[n:8][c:9]([S:13][CH3:14])[n:10][cH:11][cH:12]1.[Na+:46]>>[NH:3]([CH2:4][CH:5]([OH:6])[c:7]1[n:8][c:9]([S:13][CH3:14])[n:10][cH:11][cH:12]1)[CH:25]1[CH2:24][CH2:23][N:22]([C:20]([O:19][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:21])[CH2:27][CH2:26]1

Participants

9

Reactant 8

HCID 176Acetic AcidHCID 313Hydrochloric Acid2×HCID 887MethanolHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 735900tert-Butyl 4-oxopiperidine-1-carboxylateHCID 2724942TriacetoxyborohydrideHCID 21064659HCID 21064659, compound

Product 1

HCID 21064717HCID 21064717, compound

Sources & evidence

ORD record
ord-daf77de86796429588343e032f4136b0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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