Acetaldehyde → HCID 53857370, compound

HRID 1220486Notes

Reaction equation

HRID 1220486 reaction equation
[CH2:1]([N:2]([CH2:3][CH:4]=[CH:5][C:6]#[C:7][C:8]([CH3:9])([CH3:10])[CH3:11])[CH2:12][CH2:13][NH:14][CH2:15][CH2:16][O:17][c:18]1[cH:19][cH:20][cH:21][c:22](-[c:23]2[cH:24][cH:25][s:26][cH:27]2)[cH:28]1)[CH3:29].[CH2:33]([CH3:34])[N:35]([CH2:36][CH2:37][NH:38][CH2:39][CH:40]=[CH:41][c:42]1[cH:43][c:44](-[c:48]2[cH:49][s:50][cH:51][cH:52]2)[cH:45][cH:46][cH:47]1)[CH2:53][CH:54]=[CH:55][C:56]#[C:57][C:58]([CH3:59])([CH3:60])[CH3:61].[CH:30](=[O:31])[CH3:32]>>[CH3:1][N:38]([CH2:37][CH2:36][N:35]([CH2:33][CH3:34])[CH2:53][CH:54]=[CH:55][C:56]#[C:57][C:58]([CH3:59])([CH3:60])[CH3:61])[CH2:39][CH:40]=[CH:41][c:42]1[cH:43][c:44](-[c:48]2[cH:49][s:50][cH:51][cH:52]2)[cH:45][cH:46][cH:47]1

Participants

4

Reactant 3

HCID 177AcetaldehydeHCID 54335310HCID 54335310, compoundHCID 54476402HCID 54476402, compound

Product 1

HCID 53857370HCID 53857370, compound

Sources & evidence

ORD record
ord-be852ce282d2477daa9b7bb5bd2abc63
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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