Molecule

Isariotin K

AlkaPlorer ID: AK114671

Synonym: None

IUPAC Name: (E)-N-[(1S,2'R,3'S,5S,6S)-2'-hydroxy-4-oxospiro[7-oxabicyclo[4.1.0]hept-2-ene-5,5'-oxolane]-3'-yl]dec-2-enamide

Structure

SMILES: CCCCCCC/C=C/C(O)=N[C@H]1C[C@@]2(O[C@H]1O)C(=O)C=C[C@@H]1O[C@@H]12

InChI: InChI=1S/C19H27NO5/c1-2-3-4-5-6-7-8-9-16(22)20-13-12-19(25-18(13)23)15(21)11-10-14-17(19)24-14/h8-11,13-14,17-18,23H,2-7,12H2,1H3,(H,20,22)/b9-8+/t13-,14-,17-,18+,19+/m0/s1

InChIKey: UPQMGPGUBWPRQV-ZGHCVQBBSA-N

Reference

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

PubChem CID: 102452711

LOTUS: LTS0054818

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NPAtlas: NPA014593

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
None	Formosana	Clausiliidae	Stylommatophora	Gastropoda	Mollusca	Metazoa	Eukaryota

Properties Information

Molecule Weight: 349.4270000000001

TPSA？: 91.65

MolLogP？: 2.612000000000001

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi