Roquefortine F
AlkaPlorer ID: AK084326
Synonym: None
IUPAC Name: (1R,4E,7S,9R)-4-(1H-imidazol-5-ylmethylidene)-16-methoxy-9-(2-methylbut-3-en-2-yl)-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-triene-3,6-dione
Structure
SMILES: C=CC(C)(C)[C@@]12C[C@H]3C(O)=N/C(=C/C4=CN=CN4)C(=O)N3[C@@H]1N(OC)C1=CC=CC=C12
InChI: InChI=1S/C23H25N5O3/c1-5-22(2,3)23-11-18-19(29)26-16(10-14-12-24-13-25-14)20(30)27(18)21(23)28(31-4)17-9-7-6-8-15(17)23/h5-10,12-13,18,21H,1,11H2,2-4H3,(H,24,25)(H,26,29)/b16-10+/t18-,21+,23+/m0/s1
InChIKey: UGXLTDJSORIITQ-QTJDKHMESA-N
Reference
New alkaloids and diterpenes from a deep ocean sediment derived fungus Penicillium sp.
PubChem CID: 25223215
LOTUS: LTS0219274
{NPAtlas: NPA018601
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Penicillium sp. | Penicillium | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 419.4850000000002
TPSA？: 94.05
MolLogP？: 3.1793000000000022
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|