Acetic Acid → HCID 25057601, compound

HRID 1540613Notes

Reaction equation

HRID 1540613 reaction equation
[C:43]([O:44][BH-:45]([O:46][C:47](=[O:48])[CH3:49])[O:50][C:51](=[O:52])[CH3:53])(=[O:54])[CH3:55].[C:57]([OH:58])(=[O:59])[CH3:60].[CH2:1]([O:2][C:9](=[O:3])[N:11]1[CH2:12][CH2:13][C:14]2([CH:15]([CH2:20][CH2:21][CH2:22][CH3:23])[NH:16][C:17](=[O:19])[O:18]2)[CH2:24][CH2:25]1)[c:4]1[cH:5][cH:6][cH:7][cH:8][cH:10]1.[CH3:26][c:27]1[c:28]([C:29](=[O:30])[N:31]2[CH2:32][CH2:33][C:34](=[O:37])[CH2:35][CH2:36]2)[c:38]([CH3:42])[cH:39][cH:40][cH:41]1.[Cl:62][CH2:63][Cl:64].[NH3:61].[Na+:56]>>[CH:9]1([N:11]2[CH2:12][CH2:13][C:14]3([CH:15]([CH2:20][CH2:21][CH2:22][CH3:23])[NH:16][C:17](=[O:19])[O:18]3)[CH2:24][CH2:25]2)[CH2:33][CH2:32][N:31]([C:29]([c:28]2[c:27]([CH3:26])[cH:41][cH:40][cH:39][c:38]2[CH3:42])=[O:30])[CH2:36][CH2:35]1

Participants

8

Sources & evidence

ORD record
ord-a8e10596edc04931af89b96f5888dd57
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…