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Chemical structure of β-Obscurine

GC71905

β-Obscurine

Also known as (1R,9R,10R,16R)-14,16-dimethyl-6,14-diazatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3-dien-5-one

β-Obscurine is a lycopodine-type alkaloid, which can be isolated from the club moss Lycopodium casuarinoides

ChemicalCAS467-79-8MW272.39FormulaC17H24N2O
CAS number
467-79-8
Molecular weight
272.39
Formula
C17H24N2O
InChIKey
SIQKNJDHWYZFFT-HPTBWKMGSA-N
Catalogue number
GC71905
Brand
GLPBIO
Computed properties PubChem CID 442492 · XLogP 2 · TPSA 32.3 Ų · H-bond donors 1
XLogP
2
TPSA
32.3 Ų
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
20

SMILES C[C@@H]1C[C@@H]2CC3=C(C=CC(=O)N3)[C@@]4(C1)[C@@H]2CCCN4C

Computed descriptors from PubChem (CID 442492), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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