Ammonium → HCID 69019969, compound

HRID 697167Notes

Reaction equation

HRID 697167 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]1[CH2:9][CH2:10][CH:11]([NH:14][c:15]2[n:16][c:17]([NH:29][CH:30]3[CH2:31][CH2:32][N:33]([CH2:36][c:37]4[cH:38][cH:39][cH:40][cH:41][cH:42]4)[CH2:34][CH2:35]3)[c:18]3[n:19][cH:20][n:21]([CH:24]4[CH:25]=[CH:26][CH2:27][CH2:28]4)[c:22]3[n:23]2)[CH2:12][CH2:13]1)=[O:43].[CH3:48][OH:49].[CH:44]([O-:45])=[O:46].[NH4+:47].[OH2:50]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]1[CH2:9][CH2:10][CH:11]([NH:14][c:15]2[n:16][c:17]([NH:29][CH:30]3[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]3)[c:18]3[n:19][cH:20][n:21]([CH:24]4[CH:25]=[CH:26][CH2:27][CH2:28]4)[c:22]3[n:23]2)[CH2:12][CH2:13]1)=[O:43]

Participants

6

Reactant 5

HCID 223AmmoniumHCID 283FormateHCID 887MethanolHCID 962WaterHCID 69020812HCID 69020812, compound

Product 1

HCID 69019969HCID 69019969, compound

Sources & evidence

ORD record
ord-3973042f34904db29914ccfa6c37d8a3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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