Talatisamine
AlkaPlorer ID: AK017661
Synonym: None
IUPAC Name: (1S,2R,3R,4S,5S,6S,8S,9S,13S,16S,17R)-11-ethyl-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8-diol
Structure
SMILES: CCN1C[C@]2(COC)CC[C@H](OC)[C@]34C1[C@H](C[C@H]23)[C@@]1(O)C[C@H](OC)[C@H]2C[C@@H]4[C@@H]1[C@H]2O
InChI: InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,21?,22+,23+,24-/m1/s1
InChIKey: BDCURAWBZJMFIK-FLDLCTCNSA-N
Source
Properties Information
Molecule Weight: 421.57800000000015
TPSA？: 71.39000000000001
MolLogP？: 1.5312000000000006
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Tribolium castaneum | Tribolium castaneum | Activity | 48.77 | % | 10.1021/jf104879h |
| Tribolium castaneum | Tribolium castaneum | Activity | 58.63 | % | 10.1021/jf104879h |
| Tribolium castaneum | Tribolium castaneum | Activity | 60.82 | % | 10.1021/jf104879h |
| Tribolium castaneum | Tribolium castaneum | Activity | 75.89 | % | 10.1021/jf104879h |
| Tribolium castaneum | Tribolium castaneum | Activity | 92.47 | % | 10.1021/jf104879h |
| Tribolium castaneum | Tribolium castaneum | EC50 | 342.8 | ppm | 10.1021/jf104879h |