Molecule

beta-obscurine

AlkaPlorer ID: AK010577

Synonym: '', 'beta-Obscurine'

IUPAC Name: (1R,9S,10R,16R)-14,16-dimethyl-6,14-diazatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3-dien-5-one

Structure

SMILES: C[C@@H]1C[C@H]2CC3=NC(O)=CC=C3[C@@]3(C1)[C@@H]2CCCN3C

InChI: InChI=1S/C17H24N2O/c1-11-8-12-9-15-14(5-6-16(20)18-15)17(10-11)13(12)4-3-7-19(17)2/h5-6,11-13H,3-4,7-10H2,1-2H3,(H,18,20)/t11-,12+,13-,17-/m1/s1

InChIKey: SIQKNJDHWYZFFT-IPJQOSJUSA-N

Reference

LYCOPODIUM ALKALOIDS: XV. STRUCTURE AND MASS SPECTRA OF SOME MINOR ALKALOIDS OF L. FLABELLIFORME

PubChem CID: 5460546

CAS: 467-79-8

LOTUS: LTS0006946

NPASS: NPC244064

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Cuscuta salina	Cuscuta	Convolvulaceae	Solanales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Hebeloma longicaudum	Hebeloma	Hymenogastraceae	Agaricales	Agaricomycetes	Basidiomycota	Fungi	Eukaryota
Vitex quinata	Vitex	Lamiaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Dillenia philippinensis	Dillenia	Dilleniaceae	Dilleniales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Gaillardia pulchella	Gaillardia	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Artemisia selengensis	Artemisia	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Centaurea iberica	Centaurea	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Eriocaulon ligulatum	Eriocaulon	Eriocaulaceae	Poales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Callicarpa americana	Callicarpa	Lamiaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Grateloupia filicina	Grateloupia	Halymeniaceae	Halymeniales	Florideophyceae	Rhodophyta	None	Eukaryota
Crocus chrysanthus	Crocus	Iridaceae	Asparagales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Gunnera perpensa	Gunnera	Gunneraceae	Gunnerales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Hylobius abietis	Hylobius	Curculionidae	Coleoptera	Insecta	Arthropoda	Metazoa	Eukaryota
Perymenium berlandieri	Perymenium	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Huperzia selago	Huperzia	Lycopodiaceae	Lycopodiales	Lycopodiopsida	Streptophyta	Viridiplantae	Eukaryota
Bryothamnion triquetrum	Bryothamnion	Rhodomelaceae	Ceramiales	Florideophyceae	Rhodophyta	None	Eukaryota
Aconitum chasmanthum	Aconitum	Ranunculaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Delphinium geyeri	Delphinium	Ranunculaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Fusicolla aquaeductuum	Fusicolla	Nectriaceae	Hypocreales	Sordariomycetes	Ascomycota	Fungi	Eukaryota
Sphaerellopsis filum	Sphaerellopsis	Leptosphaeriaceae	Pleosporales	Dothideomycetes	Ascomycota	Fungi	Eukaryota
Minuria leptophylla	Minuria	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Hovea linearis	Hovea	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Litsea japonica	Litsea	Lauraceae	Laurales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Petiveria alliacea	Petiveria	Petiveriaceae	Caryophyllales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Dalbergia cochinchinensis	Dalbergia	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Gerbera crocea	Gerbera	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Malouetia tamaquarina	Malouetia	Apocynaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Wahlenbergia marginata	Wahlenbergia	Campanulaceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Gambeya africana	Gambeya	Sapotaceae	Ericales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Alexandrium peruvianum	Alexandrium	Pyrocystaceae	Gonyaulacales	Dinophyceae	None	None	Eukaryota
Penstemon centranthifolius	Penstemon	Plantaginaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Vernonia cumingiana	Vernonia	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 272.392

TPSA？: 36.36000000000001

MolLogP？: 2.9265000000000017

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 4

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi