Water → HCID 178495138, compound

HRID 164530Notes

Reaction equation

HRID 164530 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH2:35][OH:36])[CH:11]([CH2:13][N:14]([C:15](=[O:16])[c:17]2[cH:18][cH:19][c:20]3[c:21]([CH3:31])[cH:22][n:23]([CH2:26][CH2:27][CH2:28][O:29][CH3:30])[c:24]3[cH:25]2)[CH:32]([CH3:33])[CH3:34])[CH2:12]1.[CH3:37][C:38]#[N:39].[OH2:40]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH:35]=[O:36])[CH:11]([CH2:13][N:14]([C:15](=[O:16])[c:17]2[cH:18][cH:19][c:20]3[c:21]([CH3:31])[cH:22][n:23]([CH2:26][CH2:27][CH2:28][O:29][CH3:30])[c:24]3[cH:25]2)[CH:32]([CH3:33])[CH3:34])[CH2:12]1

Participants

4

Reactant 3

HCID 962WaterHCID 6342AcetonitrileHCID 178495139HCID 178495139, compound

Product 1

HCID 178495138HCID 178495138, compound

Sources & evidence

ORD record
ord-4cc526c8e3444b6ab1ab3c2094f884f9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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