Molecule

cyclostellettamine A

AlkaPlorer ID: AK000914

Synonym: None

IUPAC Name: 1,18-diazoniatricyclo[29.3.1.114,18]hexatriaconta-1(34),14(36),15,17,31(35),32-hexaene;chloride;iodide

Structure

SMILES: C1CCCCCC[N+]2=CC=CC(=C2)CCCCCCCCCCCC[N+]3=CC=CC(=C3)CCCCC1.[Cl-].[I-]

InChI: InChI=1S/C34H56N2.ClH.HI/c1-3-7-11-15-19-27-35-29-22-26-34(32-35)24-18-14-10-6-2-4-8-12-16-20-28-36-30-21-25-33(31-36)23-17-13-9-5-1;;/h21-22,25-26,29-32H,1-20,23-24,27-28H2;2*1H/q+2;;/p-2

InChIKey: QCWUNHBOTGOROL-UHFFFAOYSA-L

Reference

Cyclostellettamines A-F, pyridine alkaloids which inhibit binding of methyl quinuclidinyl benzilate (QNB) to muscarinic acetylcholine receptors, from the marine sponge, Stelletta maxima

PubChem CID: 44422969

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
None	Xestospongia	Petrosiidae	Haplosclerida	Demospongiae	Porifera	Metazoa	Eukaryota
None	Xestospongia	Petrosiidae	Haplosclerida	Demospongiae	Porifera	Metazoa	Eukaryota

Properties Information

Molecule Weight: 655.1930000000006

TPSA？: 7.76

MolLogP？: 2.8704000000000036

Number of H-Donors: 0

Number of H-Acceptors: 0

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Homo sapiens	U-937	Activity	None	None	10.1021/jm070028m