dihydromotuporamine C
AlkaPlorer ID: AK100470
Synonym: None
IUPAC Name: N'-[3-(azacyclopentadec-1-yl)propyl]propane-1,3-diamine
Structure
SMILES: NCCCNCCCN1CCCCCCCCCCCCCC1
InChI: InChI=1S/C20H43N3/c21-15-13-16-22-17-14-20-23-18-11-9-7-5-3-1-2-4-6-8-10-12-19-23/h22H,1-21H2
InChIKey: KZRLDBALULPSRS-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Neopetrosia exigua | Neopetrosia | Petrosiidae | Haplosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 325.5850000000001
TPSA？: 41.29
MolLogP？: 4.311700000000002
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Cricetulus griseus | CHO | IC50 | 10500.0 | nM | 10.1021/jm0491288 |
| Cricetulus griseus | CHO-MG | IC50 | 10000.0 | nM | 10.1021/jm0491288 |
| Cricetulus griseus | CHO-MG | Ratio | 1.0 | None | 10.1021/jm0491288 |
| Mus musculus | L1210 | IC50 | 3000.0 | nM | 10.1021/jm0491288 |
| Mus musculus | L1210 | Ki | 9900.0 | nM | 10.1021/jm0491288 |