Water → HCID 59000769, compound

HRID 1133086Notes

Reaction equation

HRID 1133086 reaction equation
[CH2:14]([CH3:15])[O:16][C:17](=[O:18])[c:19]1[c:20]([C:43]([NH2:44])=[O:45])[c:21]([CH2:40][CH2:41][CH3:42])[n:22]2[n:23][c:24]([N:34]3[CH2:35][CH2:36][O:37][CH2:38][CH2:39]3)[cH:25][c:26](-[c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[c:27]12.[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[F:1][C:2]([F:3])([F:4])[C:5]([O:6][C:7](=[O:8])[C:9]([F:10])([F:11])[F:12])=[O:13].[OH2:46]>>[CH2:14]([CH3:15])[O:16][C:17](=[O:18])[c:19]1[c:20]([C:43]#[N:44])[c:21]([CH2:40][CH2:41][CH3:42])[n:22]2[n:23][c:24]([N:34]3[CH2:35][CH2:36][O:37][CH2:38][CH2:39]3)[cH:25][c:26](-[c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[c:27]12

Participants

5

Reactant 4

HCID 962WaterHCID 8028TetrahydrofuranHCID 9845Trifluoroacetic anhydrideHCID 59000792HCID 59000792, compound

Product 1

HCID 59000769HCID 59000769, compound

Sources & evidence

ORD record
ord-127070f796f54dc380d9c432296c7790
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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