(12S,14R,16R,18R)-16-methoxy-11,18-dimethyl-17-oxa-1,11-diazapentacyclo[10.8.1.0²,⁷.0⁸,²¹.0¹⁴,¹⁹]henicosa-2,4,6,8(21),19-pentaene
AlkaPlorer ID: AK325252
Synonym: None
IUPAC Name: None
Structure
SMILES: CO[C@@H]1C[C@H]2C[C@H]3C4=C(CCN3C)C3=CC=CC=C3N4C=C2[C@@H](C)O1
InChI: InChI=1S/C21H26N2O2/c1-13-17-12-23-18-7-5-4-6-15(18)16-8-9-22(2)19(21(16)23)10-14(17)11-20(24-3)25-13/h4-7,12-14,19-20H,8-11H2,1-3H3/t13-,14-,19+,20+/m1/s1
InChIKey: CQMHDBIUNKXEQI-NSMLZSOPSA-N
Reference
NPASS: NPC69065
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hypericum choisyanum | Hypericum | Hypericaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Strychnos dale | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 338.4510000000001
TPSA？: 26.63
MolLogP？: 3.812400000000003
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|