Acetic Acid → HCID 178425762, compound

HRID 961981Notes

Reaction equation

HRID 961981 reaction equation
[C:50]([OH:51])(=[O:52])[CH3:53].[C:54]([O:55][BH-:56]([O:57][C:58](=[O:59])[CH3:60])[O:61][C:62](=[O:63])[CH3:64])(=[O:65])[CH3:66].[CH3:42][C:43]1([OH:49])[CH2:44][CH2:45][NH:46][CH2:47][CH2:48]1.[Cl:68][CH2:69][Cl:70].[Na+:67].[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:38][cH:39][cH:40][cH:41]2)[CH2:6][CH2:7][N:8]1[CH:9]1[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][CH:18]([C:19]([N:20]2[CH2:21][CH2:22][C:23](=[O:26])[CH2:24][CH2:25]2)=[O:27])[CH2:28][c:29]2[cH:30][c:31]([CH3:37])[c:32]([OH:36])[c:33]([CH3:35])[cH:34]2)[CH2:13][CH2:14]1.[O:71]=[CH:72][N:73]([CH3:74])[CH3:75]>>[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:38][cH:39][cH:40][cH:41]2)[CH2:6][CH2:7][N:8]1[CH:9]1[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][CH:18]([C:19]([N:20]2[CH2:21][CH2:22][CH:23]([N:46]3[CH2:45][CH2:44][C:43]([CH3:42])([OH:49])[CH2:48][CH2:47]3)[CH2:24][CH2:25]2)=[O:27])[CH2:28][c:29]2[cH:30][c:31]([CH3:37])[c:32]([OH:36])[c:33]([CH3:35])[cH:34]2)[CH2:13][CH2:14]1

Participants

8

Sources & evidence

ORD record
ord-ce4a25e3bff84ca8bd99ee4ebfa0d509
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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