Popolohuanone D
AlkaPlorer ID: AK310892
Synonym: None
IUPAC Name: 2-[(1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)methyl]-5-[3-[(1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)methyl]-4-hydroxyanilino]cyclohexa-2,5-diene-1,4-dione
Structure
SMILES: CC1=CCCC2C1(C)CCC(C)C2(C)CC1=CC(=O)C(NC2=CC=C(O)C(CC3(C)C(C)CCC4(C)C(C)=CCCC43)=C2)=CC1=O
InChI: InChI=1S/C42H57NO3/c1-26-11-9-13-37-39(26,5)19-17-28(3)41(37,7)24-30-21-32(15-16-34(30)44)43-33-23-35(45)31(22-36(33)46)25-42(8)29(4)18-20-40(6)27(2)12-10-14-38(40)42/h11-12,15-16,21-23,28-29,37-38,43-44H,9-10,13-14,17-20,24-25H2,1-8H3
InChIKey: GIDUUZJAUQOFGZ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Dysidea avara | Dysidea | Dysideidae | Dictyoceratida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 623.9220000000003
TPSA？: 66.4
MolLogP？: 10.296399999999997
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|