Acetic Acid → HCID 10287249, compound

HRID 688439Notes

Reaction equation

HRID 688439 reaction equation
[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.[CH3:21][C:22](=[O:23])[OH:24].[CH3:52][CH2:53][O:54][C:55]([CH3:56])=[O:57].[CH:25](=[O:26])[c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[Na+:46].[c:1]1([S:7](=[O:8])(=[O:9])[NH:10][NH:11][C:12]([c:13]2[cH:14][cH:15][c:16]([NH2:19])[cH:17][cH:18]2)=[O:20])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[NH:10][NH:11][C:12]([c:13]2[cH:14][cH:15][c:16]([NH:19][CH2:25][c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[cH:17][cH:18]2)=[O:20])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 240BenzaldehydeHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 247403HCID 247403, compoundHCID 2724942Triacetoxyborohydride

Product 1

HCID 10287249HCID 10287249, compound

Sources & evidence

ORD record
ord-0a118cfae3664d658cdcca61ce5877aa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…