Wybutoxine
AlkaPlorer ID: AK056778
Synonym: Methyl 4,9-dihydro-β-hydroperoxy-α-[(methoxycarbonyl)amino]-4,6-dimethyl-9-oxo-1H-imidazo[1,2-a]purine-7-butanoate, Peroxywybutine
IUPAC Name: methyl 4-(4,6-dimethyl-9-oxo-1H-imidazo[1,2-a]purin-7-yl)-3-hydroperoxy-2-(methoxycarbonylamino)butanoate
Structure
SMILES: COC(=O)NC(C(=O)OC)C(CC1=C(C)N=C2N(C)C3=C(NC=N3)C(=O)N12)OO
InChI: InChI=1S/C16H20N6O7/c1-7-8(5-9(29-26)10(14(24)27-3)20-16(25)28-4)22-13(23)11-12(18-6-17-11)21(2)15(22)19-7/h6,9-10,26H,5H2,1-4H3,(H,17,18)(H,20,25)
InChIKey: FRYWGCQTDZARGT-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Geotrichum candidum | Geotrichum | Dipodascaceae | Saccharomycetales | Saccharomycetes | Ascomycota | Fungi | Eukaryota |
| Lupinus luteus | Lupinus | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 408.3710000000001
TPSA？: 162.06999999999996
MolLogP？: -0.4839799999999992
Number of H-Donors: 3
Number of H-Acceptors: 11
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|