(1R,11S,12E,17S)-12-ethylidene-10-formyl-14-methyl-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2(7),3,5,9-tetraen-14-ium
AlkaPlorer ID: AK319173
Synonym: None
IUPAC Name: (1R,11S,12E,14S,17S)-12-ethylidene-14-methyl-8-aza-14-azoniapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,9-tetraene-10-carbaldehyde
Structure
SMILES: C/C=C1/C[N@+]2(C)CC[C@]34C(=C(C=O)[C@H]1C[C@@H]32)NC1=CC=CC=C14
InChI: InChI=1S/C20H22N2O/c1-3-13-11-22(2)9-8-20-16-6-4-5-7-17(16)21-19(20)15(12-23)14(13)10-18(20)22/h3-7,12,14,18H,8-11H2,1-2H3/p+1/b13-3-/t14-,18-,20+,22-/m0/s1
InChIKey: ZEMNDQUOMWGCAZ-MZFNONIYSA-O
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Megoura crassicauda | Megoura | Aphididae | Hemiptera | Insecta | Arthropoda | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 307.41700000000003
TPSA？: 29.1
MolLogP？: 3.0016000000000016
Number of H-Donors: 1
Number of H-Acceptors: 2
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|