Water → HCID 22269797, compound

HRID 2345418Notes

Reaction equation

HRID 2345418 reaction equation
[CH3:37][C:38]#[N:39].[H:29][H:30].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([CH2:10][CH2:11][CH2:12][c:13]2[cH:14][cH:15][c:16]([NH:19][c:20]3[c:21]([C:22](=[O:23])[OH:24])[cH:25][cH:26][cH:27][cH:28]3)[cH:17][cH:18]2)[cH:8][cH:9]1.[O:32]=[CH:33][N:34]([CH3:35])[CH3:36].[OH2:31]>>[NH2:1][c:4]1[cH:5][cH:6][c:7]([CH2:10][CH2:11][CH2:12][c:13]2[cH:14][cH:15][c:16]([NH:19][c:20]3[c:21]([C:22](=[O:23])[OH:24])[cH:25][cH:26][cH:27][cH:28]3)[cH:17][cH:18]2)[cH:8][cH:9]1

Participants

6

Reactant 5

HCID 962WaterHCID 6228DimethylformamideHCID 6342AcetonitrileHCID 22269765HCID 22269765, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 22269797HCID 22269797, compound

Sources & evidence

ORD record
ord-5e66fb243fa24724ba0587a08f617fed
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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