Avarol; 2',5'-Quinone, 4'-(methylamino)
AlkaPlorer ID: AK289813
Synonym: 4'-Methylaminoavarone
IUPAC Name: 2-[(1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)methyl]-5-(methylamino)cyclohexa-2,5-diene-1,4-dione
Structure
SMILES: CNC1=CC(=O)C(CC2(C)C(C)CCC3(C)C(C)=CCCC32)=CC1=O
InChI: InChI=1S/C22H31NO2/c1-14-7-6-8-20-21(14,3)10-9-15(2)22(20,4)13-16-11-19(25)17(23-5)12-18(16)24/h7,11-12,15,20,23H,6,8-10,13H2,1-5H3
InChIKey: AGVBOCPGXNSSLL-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Dysidea avara | Dysidea | Dysideidae | Dictyoceratida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 341.4950000000001
TPSA？: 46.17
MolLogP？: 4.356800000000004
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|