Avarol; Δ4(12)-Isomer, 2',5'-quinone, 3'-(dimethylamino)
AlkaPlorer ID: AK289804
Synonym: Dysidaminone J
IUPAC Name: 2-[(1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl)methyl]-6-(dimethylamino)cyclohexa-2,5-diene-1,4-dione
Structure
SMILES: C=C1CCCC2C1(C)CCC(C)C2(C)CC1=CC(=O)C=C(N(C)C)C1=O
InChI: InChI=1S/C23H33NO2/c1-15-8-7-9-20-22(15,3)11-10-16(2)23(20,4)14-17-12-18(25)13-19(21(17)26)24(5)6/h12-13,16,20H,1,7-11,14H2,2-6H3
InChIKey: DHVPVPIHMUTANQ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Dysidea fragilis | Dysidea | Dysideidae | Dictyoceratida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 355.5220000000001
TPSA？: 37.38
MolLogP？: 4.699000000000004
Number of H-Donors: 0
Number of H-Acceptors: 3
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|