Methanol → HCID 178449390, compound

HRID 667522Notes

Reaction equation

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

Participants

Reactant 5

HCID 887Methanol

HCID 923Sodium ion

HCID 961Hydroxide

HCID 8028Tetrahydrofuran

HCID 178500861methyl 2-[[2-tert-butyl-4-(furan-2-ylmethylamino)pyrimidine-5-carbonyl]-(2-methylpropyl)amino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Product 1

HCID 178449390HCID 178449390, compound

Sources & evidence

ORD record: ord-aa12447ce7e74769b9b985e31e27cda5
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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