Water → HCID 178496372, compound

HRID 2162867Notes

Reaction equation

HRID 2162867 reaction equation
[CH2:8]1[O:9][CH2:10][CH2:11][CH2:12]1.[CH3:13][C:14]([CH:15]=[CH:16][CH:17]1[CH:18]([OH:47])[CH:19]([CH:25]([C:26](=[O:27])[NH:28][CH:29]2[C:30](=[O:44])[N:31]3[CH:32]([c:33]4[c:34]([cH:36][cH:37][cH:38][cH:39]4)[CH2:35]2)[CH2:40][CH2:41][CH2:42][CH2:43]3)[O:45][CH3:46])[O:20][C:21]([CH3:23])([CH3:24])[O:22]1)([CH3:48])[CH3:49].[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[OH2:50]>>[CH3:13][C:14]([CH:15]=[CH:16][CH:17]([CH:18]([CH:19]([OH:20])[CH:25]([C:26](=[O:27])[NH:28][CH:29]1[C:30](=[O:44])[N:31]2[CH:32]([c:33]3[c:34]([cH:36][cH:37][cH:38][cH:39]3)[CH2:35]1)[CH2:40][CH2:41][CH2:42][CH2:43]2)[O:45][CH3:46])[OH:47])[OH:22])([CH3:48])[CH3:49]

Participants

5

Reactant 4

HCID 962WaterHCID 6422Trifluoroacetic acidHCID 8028TetrahydrofuranHCID 178496371HCID 178496371, compound

Product 1

HCID 178496372HCID 178496372, compound

Sources & evidence

ORD record
ord-6601cc9de5cc46e39872bb52e944da6b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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