Acetate → HCID 178449935, compound

HRID 1573016Notes

Reaction equation

HRID 1573016 reaction equation
[C:1]([CH2:2][CH2:3][CH3:4])(=[O:5])[CH:6]1[C:7](=[O:24])[CH2:8][CH:9]([CH2:17][CH:18]2[CH2:19][CH2:20][O:21][CH2:22][CH2:23]2)[CH:10]([C:13](=[O:14])[O:15][CH3:16])[C:11]1=[O:12].[CH2:26]([CH3:27])[O:28][NH3+:29].[CH3:30][CH2:31][OH:32].[CH3:34][C:35](=[O:36])[O-:37].[Cl-:25].[Na+:33]>>[C:1]([CH2:2][CH2:3][CH3:4])(=[C:6]1[C:7](=[O:24])[CH2:8][CH:9]([CH2:17][CH:18]2[CH2:19][CH2:20][O:21][CH2:22][CH2:23]2)[CH:10]([C:13](=[O:14])[O:15][CH3:16])[C:11]1=[O:12])[NH:29][O:28][CH2:26][CH3:27]

Participants

7

Reactant 6

HCID 175AcetateHCID 312ChlorideHCID 702EthanolHCID 923Sodium ionHCID 13216544HCID 13216544, compoundHCID 21719971HCID 21719971, compound

Product 1

HCID 178449935HCID 178449935, compound

Sources & evidence

ORD record
ord-05f01070f4b3484f8c61674ea42c9338
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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