Molecule

Isariotin E; 5,6-Deepoxy, 5ξ,6ξ,12'-trihydroxy

AlkaPlorer ID: AK302725

Synonym: Isariotin L

IUPAC Name: 12-hydroxy-N-(2,9,10-trihydroxy-6-oxo-1-oxaspiro[4.5]dec-7-en-3-yl)dodec-2-enamide

Structure

SMILES: O=C1C=CC(O)C(O)C12CC(N=C(O)C=CCCCCCCCCCO)C(O)O2

InChI: InChI=1S/C21H33NO7/c23-13-9-7-5-3-1-2-4-6-8-10-18(26)22-15-14-21(29-20(15)28)17(25)12-11-16(24)19(21)27/h8,10-12,15-16,19-20,23-24,27-28H,1-7,9,13-14H2,(H,22,26)

InChIKey: DQJCNOUNYPRLKJ-UHFFFAOYSA-N

Reference

Highly oxidized ergosterols and isariotin analogs from an entomopathogenic fungus, Gibellula formosana, cultivated in the presence of epigenetic modifying agents

PubChem CID: 162860341

LOTUS: LTS0235617

COCONUT: CNP0123365.2

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Gibellula formosana	Gibellula	Cordycipitaceae	Hypocreales	Sordariomycetes	Ascomycota	Fungi	Eukaryota

Properties Information

Molecule Weight: 411.4950000000003

TPSA？: 139.81

MolLogP？: 1.318999999999999

Number of H-Donors: 5

Number of H-Acceptors: 7

RingCount: 2

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi