Sclerominol; α-Hydroxy(E-)
AlkaPlorer ID: AK117113
Synonym: 5-Benzyl-1-hydroxy-3-(hydroxybenzylidene)-2,6(1H,3H)-pyrazinedione, Coelomycin
IUPAC Name: 5-benzoyl-3-benzyl-1,6-dihydroxypyrazin-2-one
Structure
SMILES: O=C1C(CC2=CC=CC=C2)=NC(=C(O)C2=CC=CC=C2)C(=O)N1O
InChI: InChI=1S/C18H14N2O4/c21-16(13-9-5-2-6-10-13)15-18(23)20(24)17(22)14(19-15)11-12-7-3-1-4-8-12/h1-10,21,24H,11H2
InChIKey: XEJYEXMNGSCPRU-UHFFFAOYSA-N
Reference
Bioactive Compounds from the Seed Fungus <i>Menisporopsis </i><i>theobromae</i> BCC 3975
LOTUS: LTS0068478
COCONUT: CNP0248066
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Menisporopsis theobromae | Menisporopsis | Chaetosphaeriaceae | Chaetosphaeriales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
| unidentified | None | None | None | None | None | None | None |
Properties Information
Molecule Weight: 322.32000000000005
TPSA？: 90.2
MolLogP？: 2.3549
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|