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Chemical structure of Cephaeline

GC43228

Cephaeline

Also known as (1R)-1-[[(2S,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-1,2,3,4-tetrahydroisoquinolin-6-ol

Cephaeline is an alkaloid originally isolated from C

ChemicalCAS483-17-0MW466.6FormulaC28H38N2O4
CAS number
483-17-0
Molecular weight
466.6
Formula
C28H38N2O4
Solubility
Acetonitrile： slightly soluble,Chloroform： slightly soluble,Ethanol： slightly soluble,Methanol： slightly soluble
InChIKey
DTGZHCFJNDAHEN-OZEXIGSWSA-N
Catalogue number
GC43228
Brand
GLPBIO
Computed properties PubChem CID 442195 · XLogP 4.4 · TPSA 63.2 Ų · H-bond donors 2
XLogP
4.4
TPSA
63.2 Ų
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
34

SMILES CC[C@H]1CN2CCC3=CC(=C(C=C3[C@@H]2C[C@@H]1C[C@@H]4C5=CC(=C(C=C5CCN4)O)OC)OC)OC

Computed descriptors from PubChem (CID 442195), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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