Malbranpyrrole E
AlkaPlorer ID: AK075238
Synonym: 'Malbranpyrrole E'
IUPAC Name: 6-[5-(3-chloro-1H-pyrrol-2-yl)penta-2,4-dien-2-yl]-4-methoxy-3-(2-methylbut-3-en-2-yl)pyran-2-one
Structure
SMILES: C=CC(C)(C)C1=C(OC)C=C(C(C)=CC=CC2=C(Cl)C=CN2)OC1=O
InChI: InChI=1S/C20H22ClNO3/c1-6-20(3,4)18-17(24-5)12-16(25-19(18)23)13(2)8-7-9-15-14(21)10-11-22-15/h6-12,22H,1H2,2-5H3
InChIKey: KMCWFIGQAAUEOM-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Malbranchea cinnamomea | Malbranchea | Malbrancheaceae | Onygenales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 359.85300000000007
TPSA？: 55.23
MolLogP？: 5.210200000000005
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|