Palmitic Acid → HCID 18780356, compound
Reaction equation
[C:43]([CH3:44])([CH3:45])([CH3:46])[O:47][C:48]([CH:49]([NH:50][C:51]([CH2:52][CH2:53][CH2:54][CH2:55][CH2:56][CH2:57][CH2:58][CH2:59][CH2:60][CH2:61][CH2:62][CH2:63][CH2:64][CH2:65][CH3:66])=[O:67])[CH2:68][SH:69])=[O:70].[CH3:19][N:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][n:26]1)[CH3:27].[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][C:16]([OH:17])=[O:18].[CH:28]1([N:29]=[C:30]=[N:31][CH:32]2[CH2:33][CH2:34][CH2:35][CH2:36][CH2:37]2)[CH2:38][CH2:39][CH2:40][CH2:41][CH2:42]1.[CH:71]([Cl:72])([Cl:73])[Cl:74]>>[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][C:16](=[O:18])[S:69][CH2:68][CH:49]([C:48]([O:47][C:43]([CH3:44])([CH3:45])[CH3:46])=[O:70])[NH:50][C:51]([CH2:52][CH2:53][CH2:54][CH2:55][CH2:56][CH2:57][CH2:58][CH2:59][CH2:60][CH2:61][CH2:62][CH2:63][CH2:64][CH2:65][CH3:66])=[O:67]Participants
6
Sources & evidence
- ORD record
- ord-6fb53dc6c2ed46829dcc18246939d969
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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