Phaeosphaeride A; Demethoxy
AlkaPlorer ID: AK309898
Synonym: Paraphaeosphaeride C
IUPAC Name: 3,4-dihydroxy-3-methyl-7-methylidene-2-pentyl-2,4-dihydropyrano[2,3-c]pyrrol-5-one
Structure
SMILES: C=C1NC(=O)C2=C1OC(CCCCC)C(C)(O)C2O
InChI: InChI=1S/C14H21NO4/c1-4-5-6-7-9-14(3,18)12(16)10-11(19-9)8(2)15-13(10)17/h9,12,16,18H,2,4-7H2,1,3H3,(H,15,17)
InChIKey: BFRMUWSVGIMJSJ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Paraphaeosphaeria neglecta | Paraphaeosphaeria | Didymosphaeriaceae | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 267.32499999999993
TPSA？: 78.79
MolLogP？: 0.975
Number of H-Donors: 3
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|