Ancistrotectoriline A
AlkaPlorer ID: AK010823
Synonym: None
IUPAC Name: (1S,3S)-5-(4,5-dimethoxy-7-methylnaphthalen-1-yl)-6,8-dimethoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline
Structure
SMILES: COC1=C(C2=CC=C(OC)C3=C(OC)C=C(C)C=C23)C2=C(C(OC)=C1)[C@H](C)N[C@@H](C)C2
InChI: InChI=1S/C26H31NO4/c1-14-10-18-17(8-9-20(28-4)26(18)21(11-14)29-5)25-19-12-15(2)27-16(3)24(19)22(30-6)13-23(25)31-7/h8-11,13,15-16,27H,12H2,1-7H3/t15-,16-/m0/s1
InChIKey: DVVAMMKTYAWPGW-HOTGVXAUSA-N
Reference
Four New Naphthylisoquinoline Alkaloids from <i>Ancistrocladus </i><i>t</i><i>ectorius</i>
PubChem CID: 10093654
LOTUS: LTS0097516
SuperNatural Ⅲ: SN0076854-01
NPASS: NPC7393
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ancistrocladus tanzaniensis | Ancistrocladus | Ancistrocladaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 421.5370000000002
TPSA？: 48.95
MolLogP？: 5.444820000000004
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Leishmania donovani | Leishmania donovani | IC50 | 10.0 | ug.mL-1 | 10.1021/np030077b |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 0.5 | ug.mL-1 | 10.1021/np030077b |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 14.0 | ug.mL-1 | 10.1021/np030077b |
| Rattus norvegicus | L6 | MIC | 6.5 | ug.mL-1 | 10.1021/np030077b |
| Trypanosoma brucei rhodesiense | Trypanosoma brucei rhodesiense | IC50 | 2.1 | ug.mL-1 | 10.1021/np030077b |
| Trypanosoma cruzi | Trypanosoma cruzi | IC50 | 17.8 | ug.mL-1 | 10.1021/np030077b |