Ancistrotectorine
AlkaPlorer ID: AK005317
Synonym: None
IUPAC Name: 2-[(1R,3S)-6,8-dimethoxy-1,2,3-trimethyl-3,4-dihydro-1H-isoquinolin-7-yl]-8-methoxy-3-methylnaphthalen-1-ol
Structure
SMILES: COC1=C(C2=C(C)C=C3C=CC=C(OC)C3=C2O)C(OC)=C2C(=C1)C[C@H](C)N(C)[C@@H]2C
InChI: InChI=1S/C26H31NO4/c1-14-11-17-9-8-10-19(29-5)23(17)25(28)21(14)24-20(30-6)13-18-12-15(2)27(4)16(3)22(18)26(24)31-7/h8-11,13,15-16,28H,12H2,1-7H3/t15-,16+/m0/s1
InChIKey: BHQAJMGEYYHIGV-JKSUJKDBSA-N
Reference
PubChem CID: 179169
CAS: 98985-59-2
LOTUS: LTS0198014
SuperNatural Ⅲ: SN0025745-02
NPASS: NPC79402
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ancistrocladus korupensis | Ancistrocladus | Ancistrocladaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Ancistrocladus tanzaniensis | Ancistrocladus | Ancistrocladaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 421.5370000000002
TPSA？: 51.16
MolLogP？: 5.484020000000005
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 | nan | None | 10.1021/np0340549 |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 0.7 | ug.mL-1 | 10.1021/np0340549 |
| Plasmodium falciparum | Plasmodium falciparum | IC50 | 9.1 | ug.mL-1 | 10.1021/np0340549 |
| Rattus norvegicus | L6 | Activity | nan | None | 10.1021/np0340549 |
| Rattus norvegicus | L6 | MIC | 19.9 | ug.mL-1 | 10.1021/np0340549 |
| Trypanosoma brucei rhodesiense | Trypanosoma brucei rhodesiense | IC50 | 4.3 | ug.mL-1 | 10.1021/np0340549 |
| Trypanosoma cruzi | Trypanosoma cruzi | IC50 | 4.3 | ug.mL-1 | 10.1021/np0340549 |