Akagerine
AlkaPlorer ID: AK026723
Synonym: ''
IUPAC Name: 2-[(5S,7R,9S)-9-hydroxy-4-methyl-4,10-diazatetracyclo[8.6.1.05,17.011,16]heptadeca-1(17),11,13,15-tetraen-7-yl]but-2-enal
Structure
SMILES: CC=C(C=O)[C@@H]1C[C@H]2C3=C(CCN2C)C2=CC=CC=C2N3[C@@H](O)C1
InChI: InChI=1S/C20H24N2O2/c1-3-13(12-23)14-10-18-20-16(8-9-21(18)2)15-6-4-5-7-17(15)22(20)19(24)11-14/h3-7,12,14,18-19,24H,8-11H2,1-2H3/t14-,18+,19+/m1/s1
InChIKey: LGSDYQBPJKYJCT-CCKFTAQKSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hypericum choisyanum | Hypericum | Hypericaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Strychnos dale | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 324.42400000000004
TPSA？: 45.47
MolLogP？: 3.216400000000002
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|