Dicentrine; (S)-form, N-De-Me
AlkaPlorer ID: AK295490
Synonym: 9,10-Dimethoxy-1,2-methylenedioxynoraporphine, (+)-Nordicentrine
IUPAC Name: 16,17-dimethoxy-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14,16,18-hexaene
Structure
SMILES: COC1=CC2=C(C=C1OC)C1=C3OCOC3=CC3=C1C(C2)NCC3
InChI: InChI=1S/C19H19NO4/c1-21-14-7-11-5-13-17-10(3-4-20-13)6-16-19(24-9-23-16)18(17)12(11)8-15(14)22-2/h6-8,13,20H,3-5,9H2,1-2H3
InChIKey: YNWJEUJZYKLCJG-UHFFFAOYSA-N
Reference
Bioactive styryllactones and alkaloid from flowers of Goniothalamus laoticus
PubChem CID: 10041981
CAS: 25394-59-6
LOTUS: LTS0056642
COCONUT: CNP0275066.2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Guatteria scandens | Guatteria | Annonaceae | Magnoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 325.36400000000003
TPSA？: 48.95
MolLogP？: 2.8424000000000005
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Mycobacterium tuberculosis | Mycobacterium tuberculosis | MIC | 12.5 | ug.mL-1 | 10.1016/j.ejmech.2022.114173 |