486992-28-3
AlkaPlorer ID: AK048604
Synonym: '', 'Neoamphimedine Z'
IUPAC Name: (3R,4R)-8-hydroxy-3,4-dimethoxy-5-methyl-5,10,20-triazapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-1,7,9,11,13(21),14,16,18-octaen-6-one
Structure
SMILES: CO[C@@H]1C2=C3NC4=CC=CC=C4C4=CC=NC(=C43)C(O)=C2C(=O)N(C)[C@@H]1OC
InChI: InChI=1S/C21H19N3O4/c1-24-20(26)15-14(19(27-2)21(24)28-3)16-13-11(8-9-22-17(13)18(15)25)10-6-4-5-7-12(10)23-16/h4-9,19,21,23,25H,1-3H3/t19-,21-/m1/s1
InChIKey: YSEPSUDKMWJQAS-TZIWHRDSSA-N
Reference
Structures and Cytotoxic Properties of Sponge-Derived Bisannulated Acridines
PubChem CID: 10872529
LOTUS: LTS0122261
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Neopetrosia carbonaria | Neopetrosia | Petrosiidae | Haplosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 377.40000000000015
TPSA？: 83.91999999999999
MolLogP？: 3.410000000000002
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|