(-)-Quebrachamine
AlkaPlorer ID: AK005303
Synonym: 'Kamassine', '(-)-Quebrachamine', 'Quebrachamine'
IUPAC Name: (15R)-15-ethyl-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraene
Structure
SMILES: CC[C@@]12CCCN(CCC3=C(CC1)NC1=CC=CC=C31)C2
InChI: InChI=1S/C19H26N2/c1-2-19-10-5-12-21(14-19)13-9-16-15-6-3-4-7-17(15)20-18(16)8-11-19/h3-4,6-7,20H,2,5,8-14H2,1H3/t19-/m1/s1
InChIKey: FDNDLNFGITWTOZ-LJQANCHMSA-N
Reference
Three novel indole alkaloids from Kopsia officinalis
PubChem CID: 92990
CAS: 4850-21-9
LOTUS: LTS0140120
NPASS: NPC2949
data_source: manually
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Kopsia arborea | Kopsia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 282.43100000000004
TPSA？: 19.03
MolLogP？: 4.148800000000003
Number of H-Donors: 1
Number of H-Acceptors: 1
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | A549 | IC50 | 30000.0 | nM | 10.1021/np800489e |
| Homo sapiens | HT-29 | IC50 | 30000.0 | nM | 10.1021/np800489e |