Molecule

florosenine

AlkaPlorer ID: AK011401

Synonym: 'Florosenine', 'O-acetylotosenine', '12-Epipetasitenine acetate', 'O-Acetyl-12-epifukinotoxin', 'Otosenine 12-acetate', 'Acetylfukinotoxin', 'acetylotosenine', 'Ligularizine'

IUPAC Name: [(1R,3'R,4R,6R,7S)-3',6,7,14-tetramethyl-3,8,17-trioxospiro[2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-4,2'-oxirane]-7-yl] acetate

Structure

SMILES: CC(=O)O[C@]1(C)C(=O)OCC2=CCN(C)CC[C@@H](OC(=O)[C@]3(C[C@H]1C)O[C@@H]3C)C2=O

InChI: InChI=1S/C21H29NO8/c1-12-10-21(13(2)29-21)19(26)28-16-7-9-22(5)8-6-15(17(16)24)11-27-18(25)20(12,4)30-14(3)23/h6,12-13,16H,7-11H2,1-5H3/t12-,13-,16-,20+,21-/m1/s1

InChIKey: RNNVXCSFOWGBQP-CDPDMYQNSA-N

Reference

Studies on constituents of crude drugs. XV. New pyrrolizidine alkaloids from Ligularia dentata.

PubChem CID: 163004270

LOTUS: LTS0037432

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Viscum multinerve	Viscum	Viscaceae	Santalales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Chrysosporium queenslandicum	Chrysosporium	Onygenaceae	Onygenales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota
Haplopappus arbutoides	Haplopappus	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Euglena longa	Euglena	Euglenaceae	Euglenales	Euglenida	Euglenozoa	None	Eukaryota
Penstemon confertus	Penstemon	Plantaginaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Bactris plumeriana	Bactris	Arecaceae	Arecales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Aspergillus duricaulis	Aspergillus	Aspergillaceae	Eurotiales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota
Gentiana lutea	Gentiana	Gentianaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Phylica rogersii	Phylica	Rhamnaceae	Rosales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Sinomenium acutum	Sinomenium	Menispermaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 423.4620000000002

TPSA？: 111.74

MolLogP？: 0.7915000000000003

Number of H-Donors: 0

Number of H-Acceptors: 9

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi