Acetic Acid → HCID 178437503, compound

HRID 945306Notes

Reaction equation

HRID 945306 reaction equation
[C:62]([O:63][BH-:64]([O:65][C:66](=[O:67])[CH3:68])[O:69][C:70](=[O:71])[CH3:72])(=[O:73])[CH3:74].[CH2:1]([CH3:2])[n:3]1[n:4][cH:5][c:6]2[c:7]1[n:8][c:9]([CH2:48][CH3:49])[c:10]([CH2:19][NH:20][C:21](=[O:22])[c:23]1[cH:24][c:25]([C:29](=[O:30])[NH:31][CH2:32][c:33]3[cH:34][c:35](-[c:40]4[cH:41][c:42]([CH:46]=[O:47])[cH:43][cH:44][cH:45]4)[c:36]([CH3:39])[cH:37][cH:38]3)[cH:26][cH:27][cH:28]1)[c:11]2[NH:12][CH:13]1[CH2:14][CH2:15][O:16][CH2:17][CH2:18]1.[CH3:50][CH:51]1[NH:52][CH:53]([CH3:57])[CH2:54][NH:55][CH2:56]1.[CH3:58][C:59](=[O:60])[OH:61].[Cl:76][CH2:77][Cl:78].[Na+:75]>>[CH2:1]([CH3:2])[n:3]1[n:4][cH:5][c:6]2[c:7]1[n:8][c:9]([CH2:48][CH3:49])[c:10]([CH2:19][NH:20][C:21](=[O:22])[c:23]1[cH:24][c:25]([C:29](=[O:30])[NH:31][CH2:32][c:33]3[cH:34][c:35](-[c:40]4[cH:41][c:42]([CH2:46][N:55]5[CH2:54][CH:53]([CH3:57])[NH:52][CH:51]([CH3:50])[CH2:56]5)[cH:43][cH:44][cH:45]4)[c:36]([CH3:39])[cH:37][cH:38]3)[cH:26][cH:27][cH:28]1)[c:11]2[NH:12][CH:13]1[CH2:14][CH2:15][O:16][CH2:17][CH2:18]1

Participants

7

Sources & evidence

ORD record
ord-d62ad0c95b1144488d7b16e5b9e7979f
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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