UNPD149020
AlkaPlorer ID: AK182521
Synonym: None
IUPAC Name: [(1S,3R,5S,6R)-6-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 3-methylbut-2-enoate
Structure
SMILES: CC(C)=CC(=O)O[C@@H]1C[C@@H]2C[C@@H](O)[C@H](C1)N2C
InChI: InChI=1S/C13H21NO3/c1-8(2)4-13(16)17-10-5-9-6-12(15)11(7-10)14(9)3/h4,9-12,15H,5-7H2,1-3H3/t9-,10-,11+,12-/m1/s1
InChIKey: UUQGYKIAWSKORN-WISYIIOYSA-N
Reference
Tropane alkaloids from Schizanthus litoralis
PubChem CID: 21599008
LOTUS: LTS0223225
SuperNatural Ⅲ: SN0380589-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Schizanthus grahamii | Schizanthus | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 239.315
TPSA？: 49.77
MolLogP？: 1.0918
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|