Ammonium → HCID 53806399, compound

HRID 1235788Notes

Reaction equation

HRID 1235788 reaction equation
[C:40]([O:41][CH2:42][CH3:43])(=[O:44])[CH3:45].[CH3:38][OH:39].[CH:34]([O-:35])=[O:36].[NH4+:37].[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:14]1[C:13]1([CH2:16][N:17]3[CH2:18][CH2:19][CH:20]([NH:23][c:24]4[n:25][cH:26][c:27]([N+:31]([O-:32])=[O:33])[c:28]([NH2:30])[n:29]4)[CH2:21][CH2:22]3)[c:12]3[c:7]([cH:8][cH:9][cH:10][cH:11]3)[CH:6]2[CH2:15]1>>[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:14]1[C:13]1([CH2:16][N:17]3[CH2:18][CH2:19][CH:20]([NH:23][c:24]4[n:25][cH:26][c:27]([NH2:31])[c:28]([NH2:30])[n:29]4)[CH2:21][CH2:22]3)[c:12]3[c:7]([cH:8][cH:9][cH:10][cH:11]3)[CH:6]2[CH2:15]1

Participants

6

Reactant 5

HCID 223AmmoniumHCID 283FormateHCID 887MethanolHCID 8857Ethyl AcetateHCID 53690835HCID 53690835, compound

Product 1

HCID 53806399HCID 53806399, compound

Sources & evidence

ORD record
ord-9f84d08776464692a17ecb703c654faa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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