2,3-Dihydro-5,7-dihydroxy-3,6-dimethyl-1H-isoindol-1-one; (±)-form, 5-O-(3,7-Dimethyl-2E,6-octadienyl), 7-Me ether, N-(2-hydroxyethyl)
AlkaPlorer ID: AK295680
Synonym: Mariline B
IUPAC Name: 5-[(2E)-3,7-dimethylocta-2,6-dienoxy]-2-(2-hydroxyethyl)-7-methoxy-3,6-dimethyl-3H-isoindol-1-one
Structure
SMILES: COC1=C(C)C(OC/C=C(\C)CCC=C(C)C)=CC2=C1C(=O)N(CCO)C2C
InChI: InChI=1S/C23H33NO4/c1-15(2)8-7-9-16(3)10-13-28-20-14-19-18(5)24(11-12-25)23(26)21(19)22(27-6)17(20)4/h8,10,14,18,25H,7,9,11-13H2,1-6H3/b16-10+
InChIKey: IDKSCTLOZOTDPO-MHWRWJLKSA-N
Reference
PubChem CID: 60166534
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Stachylidium | Plectosphaerellaceae | Glomerellales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 387.52000000000015
TPSA？: 59.0
MolLogP？: 4.584220000000005
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|