Acetic Acid → HCID 16048762, compound

HRID 2350280Notes

Reaction equation

HRID 2350280 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].[CH3:29][C:30](=[O:31])[OH:32].[CH3:50][OH:51].[CH:23]1([CH2:26][CH:27]=[O:28])[CH2:24][CH2:25]1.[Cl:47][CH2:48][Cl:49].[Na+:46].[n:1]1[n:2](-[c:11]2[cH:12][cH:13][c:14]([N:17]3[C:18](=[O:22])[CH2:19][CH2:20][CH2:21]3)[cH:15][cH:16]2)[cH:3][c:4]2[c:5]1[CH2:6][CH2:7][NH:8][CH2:9][CH2:10]2>>[n:1]1[n:2](-[c:11]2[cH:12][cH:13][c:14]([N:17]3[C:18](=[O:22])[CH2:19][CH2:20][CH2:21]3)[cH:15][cH:16]2)[cH:3][c:4]2[c:5]1[CH2:6][CH2:7][N:8]([CH2:26][CH:23]1[CH2:24][CH2:25]1)[CH2:9][CH2:10]2

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 6344DichloromethaneHCID 2724942TriacetoxyborohydrideHCID 103078492-CyclopropylacetaldehydeHCID 66930837HCID 66930837, compound

Product 1

HCID 16048762HCID 16048762, compound

Sources & evidence

ORD record
ord-6aebe242100943dfa3286be8f1f00350
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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