Roquefortine C; 9-Bromo
AlkaPlorer ID: AK312651
Synonym: 11-Bromoroquefortine C
IUPAC Name: None
Structure
SMILES: C=CC(C)(C)C12CC3C(=O)N/C(=C/C4=CNC=N4)C(=O)N3C1NC1=CC=C(Br)C=C12
InChI: InChI=1S/C22H22BrN5O2/c1-4-21(2,3)22-9-17-18(29)26-16(8-13-10-24-11-25-13)19(30)28(17)20(22)27-15-6-5-12(23)7-14(15)22/h4-8,10-11,17,20,27H,1,9H2,2-3H3,(H,24,25)(H,26,29)/b16-8+
InChIKey: LPLFVWKHFVLGEC-LZYBPNLTSA-N
Reference
CAS: 1636883-57-2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Penicillium chrysogenum | Penicillium | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 468.3550000000001
TPSA？: 90.12
MolLogP？: 3.145600000000001
Number of H-Donors: 3
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|