6-Hydroxyhyoscyamine; (2'S,3S,6S)-form, N-Oxide
AlkaPlorer ID: AK301286
Synonym: 6-Hydroxyhyoscyamine N-oxide
IUPAC Name: (6-hydroxy-8-methyl-8-oxido-8-azoniabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-phenylpropanoate
Structure
SMILES: C[N+]1([O-])C2CC(OC(=O)C(CO)C3=CC=CC=C3)CC1C(O)C2
InChI: InChI=1S/C17H23NO5/c1-18(22)12-7-13(9-15(18)16(20)8-12)23-17(21)14(10-19)11-5-3-2-4-6-11/h2-6,12-16,19-20H,7-10H2,1H3
InChIKey: KTEZTXILEWEQIF-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Physochlaina | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 321.3730000000001
TPSA？: 89.82000000000001
MolLogP？: 0.9142999999999992
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|