None
AlkaPlorer ID: AK324374
Synonym: None
IUPAC Name: (1S,2S,9S,10S)-4-amino-2,9-dimethyl-12-oxa-3,5-diazatricyclo[7.2.1.02,7]dodeca-3,6-diene-1,10-diol
Structure
SMILES: C[C@]12NC(=N)NC=C1C[C@]1(C)O[C@@]2(O)C[C@@H]1O
InChI: InChI=1S/C11H17N3O3/c1-9-3-6-5-13-8(12)14-10(6,2)11(16,17-9)4-7(9)15/h5,7,15-16H,3-4H2,1-2H3,(H3,12,13,14)/t7-,9-,10-,11-/m0/s1
InChIKey: MJEJONUTPCTFCS-ASXGKARISA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Taricha granulosa | Taricha | Salamandridae | Caudata | Amphibia | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 239.275
TPSA？: 97.6
MolLogP？: -0.6112300000000006
Number of H-Donors: 5
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bacillus subtilis | Bacillus subtilis | Activity | None | None | 10.1021/acs.jnatprod.0c00623 |
| Candida | Candida | Activity | None | None | 10.1021/acs.jnatprod.0c00623 |
| Homo sapiens | Sodium channel protein type V alpha subunit | Inhibition | None | % | 10.1021/acs.jnatprod.0c00623 |
| Pseudomonas putida | Pseudomonas putida | Activity | None | None | 10.1021/acs.jnatprod.0c00623 |