23,23-dimethyl-5,7,17-trioxa-23-azahexacyclo[10.10.1.0²,¹?.0?,?.0¹³,²¹.0¹?,¹?]tricosa-2,4(8),9,13,15(19),20-hexaen-23-ium
AlkaPlorer ID: AK322580
Synonym: None
IUPAC Name: (1S,12S)-23,23-dimethyl-5,7,17-trioxa-23-azoniahexacyclo[10.10.1.02,10.04,8.013,21.015,19]tricosa-2,4(8),9,13,15(19),20-hexaene
Structure
SMILES: C[N+]1(C)[C@H]2CC3=C(C=C4OCOC4=C3)[C@@H]1CC1=CC3=C(C=C12)COC3
InChI: InChI=1S/C21H22NO3/c1-22(2)18-6-13-7-20-21(25-11-24-20)8-17(13)19(22)5-12-3-14-9-23-10-15(14)4-16(12)18/h3-4,7-8,18-19H,5-6,9-11H2,1-2H3/q+1/t18-,19-/m0/s1
InChIKey: UKXXQEQKOSUQKT-OALUTQOASA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Eschscholzia californica | Eschscholzia | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 336.4110000000001
TPSA？: 27.69
MolLogP？: 3.416500000000002
Number of H-Donors: 0
Number of H-Acceptors: 3
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|