Avarol; Δ4(12)-Isomer, 2',5'-quinone, 4'-(2-methylpropylamino)
AlkaPlorer ID: AK289806
Synonym: Dysidaminone K
IUPAC Name: 2-[(1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl)methyl]-5-(2-methylpropylamino)cyclohexa-2,5-diene-1,4-dione
Structure
SMILES: C=C1CCCC2C1(C)CCC(C)C2(C)CC1=CC(=O)C(NCC(C)C)=CC1=O
InChI: InChI=1S/C25H37NO2/c1-16(2)15-26-20-13-21(27)19(12-22(20)28)14-25(6)18(4)10-11-24(5)17(3)8-7-9-23(24)25/h12-13,16,18,23,26H,3,7-11,14-15H2,1-2,4-6H3
InChIKey: CNHYCMBGUOYHHN-UHFFFAOYSA-N
Reference
Roseosporol A, the first isolation of a novel sesquiterpenoid from <i>Streptomyces roseosporus</i>
PubChem CID: 162855928
COCONUT: CNP0118709.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Dysidea fragilis | Dysidea | Dysideidae | Dictyoceratida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 383.57600000000014
TPSA？: 46.17
MolLogP？: 5.3830000000000044
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|