Gentiocrucine
AlkaPlorer ID: AK299163
Synonym: 3-(Aminomethylene)dihydro-2H-pyran-2,4(3H)-dione, Gentianaine
IUPAC Name: 4-hydroxy-5-methanimidoyl-2,3-dihydropyran-6-one
Structure
SMILES: N/C=C1\C(=O)CCOC1=O
InChI: InChI=1S/C6H7NO3/c7-3-4-5(8)1-2-10-6(4)9/h3H,1-2,7H2/b4-3+
InChIKey: JCVFDMOXFXJTSJ-ONEGZZNKSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Gentiana cruciata | Gentiana | Gentianaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Enicostema | Gentianaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Swertia angustifolia | Swertia | Gentianaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 141.12599999999998
TPSA？: 69.39000000000001
MolLogP？: -0.655
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|