Acetic Acid → HCID 10381413, compound

HRID 1233705Notes

Reaction equation

HRID 1233705 reaction equation
[CH2:1]([CH3:2])[C:3]1([CH2:18][c:19]2[n:20][cH:21][n:22]([C:25]([c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)([c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[c:38]3[cH:39][cH:40][cH:41][cH:42][cH:43]3)[c:23]2[CH3:24])[CH2:4][CH2:5][c:6]2[n:7]([c:8]3[cH:9][cH:10][cH:11][cH:12][c:13]3[c:14]2[CH3:15])[C:16]1=[O:17].[CH3:44][C:45](=[O:46])[OH:47].[OH2:48]>>[CH2:1]([CH3:2])[C:3]1([CH2:18][c:19]2[n:20][cH:21][nH:22][c:23]2[CH3:24])[CH2:4][CH2:5][c:6]2[n:7]([c:8]3[cH:9][cH:10][cH:11][cH:12][c:13]3[c:14]2[CH3:15])[C:16]1=[O:17]

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 962WaterHCID 11757602HCID 11757602, compound

Product 1

HCID 10381413HCID 10381413, compound

Sources & evidence

ORD record
ord-208f6af827cc4081a108fea08ab4b34f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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