luotonin C
AlkaPlorer ID: AK039820
Synonym: '', 'Luotonin C'
IUPAC Name: 13-methoxy-3-methyl-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-3,5(16),6,8,10,12,14-heptaen-2-one
Structure
SMILES: COC1=CC=C2C3=CC=NC4=C3N(C(=O)C(C)=C4)C2=C1
InChI: InChI=1S/C16H12N2O2/c1-9-7-13-15-12(5-6-17-13)11-4-3-10(20-2)8-14(11)18(15)16(9)19/h3-8H,1-2H3
InChIKey: SSJVLBBMZMJFSN-UHFFFAOYSA-N
Reference
Alkaloids and phenylpropanoids from Peganum nigellastrum
PubChem CID: 102369825
CAS: 261948-33-8
LOTUS: LTS0237470
SuperNatural Ⅲ: SN0354033
COCONUT: CNP0275505
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Peganum nigellastrum | Peganum | Nitrariaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 264.28399999999993
TPSA？: 43.6
MolLogP？: 2.755720000000001
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | HL-60 | IC50 | 10000.0 | nM | 10.1021/acs.jnatprod.6b01146 |
| Homo sapiens | PC-3 | IC50 | 10000.0 | nM | 10.1021/acs.jnatprod.6b01146 |
| Homo sapiens | SGC-7901 | IC50 | 10000.0 | nM | 10.1021/acs.jnatprod.6b01146 |