(12S,20R)-11,20-dimethyl-1,11,17-triazapentacyclo[10.8.1.0²,⁷.0⁸,²¹.0¹⁴,¹⁹]henicosa-2,4,6,8(21),14(19),15,17-heptaene
AlkaPlorer ID: AK207174
Synonym: None
IUPAC Name: (12S,20R)-11,20-dimethyl-1,11,17-triazapentacyclo[10.8.1.02,7.08,21.014,19]henicosa-2,4,6,8(21),14(19),15,17-heptaene
Structure
SMILES: C[C@@H]1C2=CN=CC=C2C[C@H]2C3=C(CCN2C)C2=CC=CC=C2N31
InChI: InChI=1S/C20H21N3/c1-13-17-12-21-9-7-14(17)11-19-20-16(8-10-22(19)2)15-5-3-4-6-18(15)23(13)20/h3-7,9,12-13,19H,8,10-11H2,1-2H3/t13-,19+/m1/s1
InChIKey: YFWSIGRPVGRELZ-YJYMSZOUSA-N
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: 303.409
TPSA？: 21.06
MolLogP？: 3.7307000000000032
Number of H-Donors: 0
Number of H-Acceptors: 3
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|