(1R,3S,4R,5S,7R)-6-methyl-2-oxa-6-azatricyclo[3.3.1.0³,⁷]nonan-4-yl (2R)-2,3-dihydroxy-2-phenylpropanoate
AlkaPlorer ID: AK268675
Synonym: None
IUPAC Name: [(1R,3S,4R,5S,7R)-6-methyl-2-oxa-6-azatricyclo[3.3.1.03,7]nonan-4-yl] (2R)-2,3-dihydroxy-2-phenylpropanoate
Structure
SMILES: CN1[C@@H]2C[C@@H]3C[C@H]1[C@@H](OC(=O)[C@](O)(CO)C1=CC=CC=C1)[C@H]2O3
InChI: InChI=1S/C17H21NO5/c1-18-12-7-11-8-13(18)15(14(12)22-11)23-16(20)17(21,9-19)10-5-3-2-4-6-10/h2-6,11-15,19,21H,7-9H2,1H3/t11-,12-,13+,14+,15-,17+/m1/s1
InChIKey: XPSOWKZBQQGOCO-IXYRMGKJSA-N
Reference
Alkaloids of Scopolia tangutica
PubChem CID: 163041692
LOTUS: LTS0127834
SuperNatural Ⅲ: SN0436705-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Anisodus tanguticus | Anisodus | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 319.357
TPSA？: 79.23
MolLogP？: 0.0220999999999995
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|