Water → HCID 178496389, compound

HRID 2315160Notes

Reaction equation

HRID 2315160 reaction equation
[CH2:8]1[O:9][CH2:10][CH2:11][CH2:12]1.[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[OH2:55].[c:13]1(-[c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[cH:14][cH:15][c:16]([CH2:19][N:20]2[C:21](=[O:48])[CH:22]([NH:27][C:28]([CH:29]([O:30][CH3:31])[CH:32]3[O:33][C:34]([CH3:45])([CH3:46])[O:35][CH:36]([CH:39]=[CH:40][C:41]([CH3:42])([CH3:43])[CH3:44])[CH:37]3[OH:38])=[O:47])[CH2:23][CH2:24][CH2:25][CH2:26]2)[cH:17][cH:18]1>>[c:13]1(-[c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[cH:14][cH:15][c:16]([CH2:19][N:20]2[C:21](=[O:48])[CH:22]([NH:27][C:28]([CH:29]([O:30][CH3:31])[CH:32]([OH:33])[CH:37]([CH:36]([OH:35])[CH:39]=[CH:40][C:41]([CH3:42])([CH3:43])[CH3:44])[OH:38])=[O:47])[CH2:23][CH2:24][CH2:25][CH2:26]2)[cH:17][cH:18]1

Participants

5

Reactant 4

HCID 962WaterHCID 6422Trifluoroacetic acidHCID 8028TetrahydrofuranHCID 178496387HCID 178496387, compound

Product 1

HCID 178496389HCID 178496389, compound

Sources & evidence

ORD record
ord-de3fb9600b1741fc8d9188af1502f7aa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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