Thiaplidiaquinone A
AlkaPlorer ID: AK315935
Synonym: None
IUPAC Name: 6-(2,6-dimethylhepta-1,5-dienyl)-4-(3,7-dimethylocta-2,6-dienyl)-2-hydroxy-8,8-dioxo-6,9,10,11-tetrahydrochromeno[4,3-g][1,4]benzothiazine-7,12-dione
Structure
SMILES: CC(C)=CCCC(C)=CCC1=CC(O)=CC2=C1OC(C=C(C)CCC=C(C)C)C1=C2C(=O)C2=C(C1=O)S(=O)(=O)CCN2
InChI: InChI=1S/C34H41NO6S/c1-20(2)9-7-11-22(5)13-14-24-18-25(36)19-26-28-29(27(41-33(24)26)17-23(6)12-8-10-21(3)4)32(38)34-30(31(28)37)35-15-16-42(34,39)40/h9-10,13,17-19,27,35-36H,7-8,11-12,14-16H2,1-6H3
InChIKey: QDJNMAHTJHYJNV-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aplidium conicum | Aplidium | Polyclinidae | Aplousobranchia | Ascidiacea | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 591.7700000000002
TPSA？: 109.77
MolLogP？: 6.216100000000007
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|