Ethyl Acetate → HCID 18697752, compound

HRID 1544447Notes

Reaction equation

HRID 1544447 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[cH:10][c:11]([N+:36]([O-:37])=[O:38])[c:12]([C:13](=[O:14])[c:15]2[n:16][n:17][n:18]([CH2:25][c:26]3[cH:27][cH:28][c:29]([O:32][CH3:33])[cH:30][cH:31]3)[c:19]2[C:20](=[O:21])[O:22][CH2:23][CH3:24])[cH:34][cH:35]1.[C:39]([O:40][C:41]([NH:42][c:43]1[cH:44][cH:45][c:46]([C:47]([c:48]2[n:49]([CH2:50][c:51]3[cH:52][cH:53][c:54]([O:55][CH3:56])[cH:57][cH:58]3)[n:59][n:60][c:61]2[C:62]([O:63][CH2:64][CH3:65])=[O:66])=[O:67])[c:68]([N+:69]([O-:70])=[O:71])[cH:72]1)=[O:73])([CH3:74])([CH3:75])[CH3:76].[CH3:77][CH2:78][O:79][C:80](=[O:81])[CH3:82]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[cH:10][c:11]([NH2:36])[c:12]([C:13](=[O:14])[c:15]2[n:16][n:17][n:18]([CH2:25][c:26]3[cH:27][cH:28][c:29]([O:32][CH3:33])[cH:30][cH:31]3)[c:19]2[C:20](=[O:21])[O:22][CH2:23][CH3:24])[cH:34][cH:35]1

Participants

4

Reactant 3

HCID 8857Ethyl AcetateHCID 18697866HCID 18697866, compoundHCID 18697913HCID 18697913, compound

Product 1

HCID 18697752HCID 18697752, compound

Sources & evidence

ORD record
ord-e5c80cfb97144143813199874fa3bdba
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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