2-Hydroxy-7-methoxy-10,13-dimethyl-9-oxo-10-azoniapentacyclo[9.7.1.02,10.03,8.015,19]nonadeca-1(18),3(8),4,6,11,13,15(19),16-octaen-18-olate
AlkaPlorer ID: AK326633
Synonym: None
IUPAC Name: 2-hydroxy-7-methoxy-10,13-dimethyl-9-oxo-10-azoniapentacyclo[9.7.1.02,10.03,8.015,19]nonadeca-1(18),3(8),4,6,11,13,15(19),16-octaen-18-olate
Structure
SMILES: COC1=CC=CC2=C1C(=O)[N+]1(C)[C-]3C=C(C)C=C4C=CC(=O)C(=C43)C21O
InChI: InChI=1S/C21H17NO4/c1-11-9-12-7-8-15(23)19-17(12)14(10-11)22(2)20(24)18-13(21(19,22)25)5-4-6-16(18)26-3/h4-10,25H,1-3H3
InChIKey: DZVWGUSBMQWKQX-UHFFFAOYSA-N
Reference
Lugdunomycin, an Angucycline‐Derived Molecule with Unprecedented Chemical Architecture
PubChem CID: 163192541
LOTUS: LTS0246887
{NPAtlas: NPA025661
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces sp. QL37 | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 347.3700000000001
TPSA？: 63.60000000000001
MolLogP？: 2.485420000000001
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|