Acetic Acid → HCID 21192593, compound

HRID 169337

Reaction equation

HRID 169337 reaction equation
[C:34]([O:35][BH-:36]([O:37][C:38](=[O:39])[CH3:40])[O:41][C:42](=[O:43])[CH3:44])(=[O:45])[CH3:46].[CH3:48][C:49](=[O:50])[OH:51].[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]2[CH2:8][CH2:9][O:10][CH2:11][CH2:12]2)[cH:13][cH:14]1.[Na+:47].[O:15]1[CH2:16][CH2:17][CH2:18][CH2:19]1.[O:20]=[C:21]1[CH2:22][CH2:23][N:24]([C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[CH2:25][CH2:26]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]2[CH2:8][CH2:9][O:10][CH2:11][CH2:12]2)[cH:13][cH:14]1)[CH:21]1[CH2:22][CH2:23][N:24]([C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[CH2:25][CH2:26]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 735900tert-Butyl 4-oxopiperidine-1-carboxylateHCID 7768514-(Morpholinomethyl)anilineHCID 2724942Triacetoxyborohydride

Product 1

HCID 21192593HCID 21192593, compound

Sources & evidence

ORD record
ord-b2d23fe423bd48a3a8bd44883bb1b761
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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