Molecule

Aphylline

AlkaPlorer ID: AK014124

Synonym: '', 'MLS002919946', 'Deoxylupanoline', 'Dihydromonspessulanine', 'SMR001797545', 'Epiaphylline', '17-Oxosparteine', 'Aphylline', 'Oxosparteine', '17-Oxo-beta-isosparteine', '10-Oxo-beta-isosparteine', 'Dehydroaphylline', '0-Oxo-alpha-isosparteine', 'MLSMR', 'Anhydrodihydrolupanoline', '17-Oxo-alpha-isosparteine'

IUPAC Name: (1R,2S,9S,10R)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-8-one

Structure

SMILES: O=C1[C@H]2C[C@H](CN3CCCC[C@H]23)[C@@H]2CCCCN12

InChI: InChI=1S/C15H24N2O/c18-15-12-9-11(13-5-2-4-8-17(13)15)10-16-7-3-1-6-14(12)16/h11-14H,1-10H2/t11-,12+,13+,14-/m1/s1

InChIKey: YQMWQSMYVPLYDI-ZOBORPQBSA-N

Reference

(−)-3β-13α-dihydroxylupanine from cytisus scoparius

PubChem CID: 51018055

LOTUS: LTS0030220

SuperNatural Ⅲ: SN0457578-13

NPASS: NPC139134

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Pistia stratiotes	Pistia	Araceae	Alismatales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Plagiodera versicolora	Plagiodera	Chrysomelidae	Coleoptera	Insecta	Arthropoda	Metazoa	Eukaryota
Lupinus mexicanus	Lupinus	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Ocimum basilicum	Ocimum	Lamiaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Brickellia cylindracea	Brickellia	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Crotalaria medicaginea	Crotalaria	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Rubus lambertianus	Rubus	Rosaceae	Rosales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Fritillaria stenanthera	Fritillaria	Liliaceae	Liliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Magnolia coco	Magnolia	Magnoliaceae	Magnoliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Cytisus scoparius	Cytisus	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Leplaea thompsonii	Leplaea	Meliaceae	Sapindales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Yucca recurvifolia	Yucca	Asparagaceae	Asparagales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Erechtites hieraciifolius	Erechtites	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 248.36999999999995

TPSA？: 23.550000000000004

MolLogP？: 1.8717

Number of H-Donors: 0

Number of H-Acceptors: 2

RingCount: 4

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi