Acetic Acid → HCID 68835236, compound

HRID 1123334Notes

Reaction equation

HRID 1123334 reaction equation
[C:37]([CH3:38])(=[O:39])[OH:40].[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7](-[c:18]2[cH:19][c:20]([CH:24]=[O:25])[cH:21][cH:22][cH:23]2)[c:8]([Br:17])[c:9]1[O:10][CH2:11][C:12](=[O:13])[O:14][CH2:15][CH3:16].[CH3:26][C:27]1([CH3:36])[CH2:28][CH:29]([NH2:35])[CH2:30][C:31]([CH3:33])([CH3:34])[CH2:32]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7](-[c:18]2[cH:19][c:20]([CH2:24][N:35]([CH:29]3[CH2:28][C:27]([CH3:26])([CH3:36])[CH2:32][C:31]([CH3:33])([CH3:34])[CH2:30]3)[C:37]([CH3:38])=[O:39])[cH:21][cH:22][cH:23]2)[c:8]([Br:17])[c:9]1[O:10][CH2:11][C:12](=[O:13])[O:14][CH2:15][CH3:16]

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 22175131HCID 22175131, compoundHCID 86600646HCID 86600646, compound

Product 1

HCID 68835236HCID 68835236, compound

Sources & evidence

ORD record
ord-33223878956140dfa9ca7c9af1a920e4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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