Paramagnetoquinone C; 9-Deoxy, 9-(methylamino), 4-Me ether
AlkaPlorer ID: AK144962
Synonym: Paramagnetoquinone A
IUPAC Name: 21-hydroxy-9-methoxy-17-(methylamino)-6-oxapentacyclo[11.8.0.03,11.04,8.015,20]henicosa-1(13),3,8,10,14,17,20-heptaene-2,7,12,16,19-pentone
Structure
SMILES: CNC1=CC(=O)C2=C(O)C3=C(C=C2C1=O)C(=O)C1=CC(OC)=C2C(=O)OCC2=C1C3=O
InChI: InChI=1S/C22H13NO8/c1-23-11-5-12(24)15-7(19(11)26)3-8-17(21(15)28)20(27)14-9(18(8)25)4-13(30-2)16-10(14)6-31-22(16)29/h3-5,23,28H,6H2,1-2H3
InChIKey: KXXPVAWMGYJIRL-UHFFFAOYSA-N
Reference
Antibacterial Paramagnetic Quinones from <i>Actinoallomurus</i>
PubChem CID: 132576259
LOTUS: LTS0269025
NPASS: NPC487515
COCONUT: CNP0359714
{NPAtlas: NPA022213
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Actinoallomurus sp. | Actinoallomurus | Thermomonosporaceae | Streptosporangiales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 419.34500000000025
TPSA？: 136.07000000000002
MolLogP？: 0.8888999999999997
Number of H-Donors: 2
Number of H-Acceptors: 9
RingCount: 5