Leptanthine; N-Oxide
AlkaPlorer ID: AK304150
Synonym: Leptanthine N-oxide
IUPAC Name: (7-hydroxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl)methyl 2,3-dihydroxy-2-(1-hydroxyethyl)-3-methylbutanoate
Structure
SMILES: CC(O)C(O)(C(=O)OCC1=CC[N+]2([O-])CCC(O)C12)C(C)(C)O
InChI: InChI=1S/C15H25NO7/c1-9(17)15(21,14(2,3)20)13(19)23-8-10-4-6-16(22)7-5-11(18)12(10)16/h4,9,11-12,17-18,20-21H,5-8H2,1-3H3
InChIKey: JUNWPSWVBFLVSM-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Echium vulgare | Echium | Boraginaceae | Boraginales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 331.365
TPSA？: 130.28
MolLogP？: -1.1997999999999978
Number of H-Donors: 4
Number of H-Acceptors: 7
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|