Conithiaquinone A
AlkaPlorer ID: AK292919
Synonym: None
IUPAC Name: 10-hydroxy-9-methoxy-6,6,9-trimethyl-1,1-dioxo-2,3,4,6a,7,8,9a,10-octahydroindeno[5,6-g][1,4]benzothiazine-5,11-dione
Structure
SMILES: COC1(C)CCC2C1C(O)C1=C(C(=O)C3=C(C1=O)S(=O)(=O)CCN3)C2(C)C
InChI: InChI=1S/C19H25NO6S/c1-18(2)9-5-6-19(3,26-4)11(9)14(21)10-12(18)16(23)13-17(15(10)22)27(24,25)8-7-20-13/h9,11,14,20-21H,5-8H2,1-4H3
InChIKey: NAEALGVIKXJZBZ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aplidium conicum | Aplidium | Polyclinidae | Aplousobranchia | Ascidiacea | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 395.47700000000015
TPSA？: 109.77
MolLogP？: 0.4963999999999998
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|