Acetic Acid → HCID 59656343, compound

HRID 1116912Notes

Reaction equation

HRID 1116912 reaction equation
[C:1]([OH:2])(=[O:3])[CH3:4].[CH3:34][OH:35].[Cl:28][C:29](=[O:30])[O:31][CH2:32][CH3:33].[NH:5]1[CH2:6][CH2:7][CH:8]([NH:11][S:12](=[O:13])(=[O:14])[c:15]2[cH:16][cH:17][c:18]([CH:25]([CH3:26])[OH:27])[c:19]3[cH:20][cH:21][cH:22][cH:23][c:24]23)[CH2:9][CH2:10]1>>[N:5]1([C:29](=[O:30])[O:31][CH2:32][CH3:33])[CH2:6][CH2:7][CH:8]([NH:11][S:12](=[O:13])(=[O:14])[c:15]2[cH:16][cH:17][c:18]([CH:25]([CH3:26])[OH:27])[c:19]3[cH:20][cH:21][cH:22][cH:23][c:24]23)[CH2:9][CH2:10]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 887MethanolHCID 10928Ethyl chloroformateHCID 59656549HCID 59656549, compound

Product 1

HCID 59656343HCID 59656343, compound

Sources & evidence

ORD record
ord-c6a73085b9de4c22be13344953174af5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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