Acetic Acid → HCID 178517966, compound

HRID 663241Notes

Reaction equation

HRID 663241 reaction equation
[C:44]([OH:45])(=[O:46])[CH3:47].[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[CH:28](=[O:29])[c:30]1[cH:31][c:32]([B:36]([OH:37])[OH:38])[cH:33][cH:34][cH:35]1.[CH:3]1([NH:9][C:10]2=[N:11][C:12](=[O:27])[N:13]([c:20]3[cH:21][c:22]([F:26])[cH:23][cH:24][cH:25]3)[C:14]23[CH2:15][CH2:16][NH2+:17][CH2:18][CH2:19]3)[CH2:4][CH2:5][CH2:6][CH2:7][CH2:8]1.[ClH:1].[ClH:2]>>[CH:3]1([NH:9][C:10]2=[N:11][C:12](=[O:27])[N:13]([c:20]3[cH:21][c:22]([F:26])[cH:23][cH:24][cH:25]3)[C:14]23[CH2:15][CH2:16][N:17]([CH2:28][c:30]2[cH:31][c:32]([B:36]([OH:37])[OH:38])[cH:33][cH:34][cH:35]2)[CH2:18][CH2:19]3)[CH2:4][CH2:5][CH2:6][CH2:7][CH2:8]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 313Hydrochloric Acid2×HCID 8028TetrahydrofuranHCID 27343563-Formylphenylboronic acidHCID 178517970HCID 178517970, compound

Product 1

HCID 178517966HCID 178517966, compound

Sources & evidence

ORD record
ord-ddd387cbb9c14528a5a1981f6cc7487b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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