2-{5,15-dihydroxy-4,16-dimethoxy-10-azatetracyclo[7.7.1.0²,?.0¹³,¹?]heptadeca-1(16),2(7),3,5,13(17),14-hexaen-10-yl}acetonitrile
AlkaPlorer ID: AK254133
Synonym: None
IUPAC Name: 2-[(6aS)-2,9-dihydroxy-1,10-dimethoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-yl]acetonitrile
Structure
SMILES: COC1=CC2=C(C=C1O)C[C@H]1C3=C(C=C(O)C(OC)=C23)CCN1CC#N
InChI: InChI=1S/C20H20N2O4/c1-25-17-10-13-12(9-15(17)23)7-14-18-11(3-5-22(14)6-4-21)8-16(24)20(26-2)19(13)18/h8-10,14,23-24H,3,5-7H2,1-2H3/t14-/m0/s1
InChIKey: GITOUTAPMZCUDL-AWEZNQCLSA-N
Reference
N-Cyanomethylnorboldine: A New Aporphine Isolated from Alseodaphne perakensis (Lauraceae)
PubChem CID: 162869381
LOTUS: LTS0019238
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Alseodaphne perakensis | Alseodaphne | Lauraceae | Laurales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 352.39000000000016
TPSA？: 85.95
MolLogP？: 2.760880000000001
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|