Acetic Acid → HCID 77967092, compound

HRID 697021Notes

Reaction equation

HRID 697021 reaction equation
[CH3:35][C:36](=[O:37])[OH:38].[CH3:39][CH2:40][OH:41].[CH:24](=[O:25])[c:26]1[c:27]2[cH:28][cH:29][nH:30][c:31]2[cH:32][cH:33][cH:34]1.[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[cH:8][c:9]([NH:22][NH2:23])[n:10][c:11]3[n:12]2[n:13][c:14](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:15]3)[CH2:5][CH2:6]1>>[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[cH:8][c:9]([NH:22][N:23]=[CH:24][c:26]3[c:27]4[cH:28][cH:29][nH:30][c:31]4[cH:32][cH:33][cH:34]3)[n:10][c:11]3[n:12]2[n:13][c:14](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:15]3)[CH2:5][CH2:6]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 702EthanolHCID 333703Indole-4-carboxaldehydeHCID 70867226HCID 70867226, compound

Product 1

HCID 77967092HCID 77967092, compound

Sources & evidence

ORD record
ord-5216fce88f734719b28f5024e0d21b0c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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