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Chemical structure of Dehydronuciferine

GC38625

Dehydronuciferine

Also known as 15,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,8,13,15-heptaene

Dehydronuciferine is isolated from the leaves of Nelumbo nucifera Gaertn, a acetylcholinesterase (AChE) inhibitor with an IC50 of 25 μg/mL

ChemicalCAS7630-74-2MW293.36FormulaC19H19NO2
CAS number
7630-74-2
Molecular weight
293.36
Formula
C19H19NO2
Solubility
DMSO ： 100 mg/mL (340·88 mM; Need ultrasonic)
InChIKey
JBGSWIBJAGBGOP-UHFFFAOYSA-N
Catalogue number
GC38625
Brand
GLPBIO
Computed properties PubChem CID 821347 · XLogP 4.5 · TPSA 21.7 Ų · H-bond donors 0
XLogP
4.5
TPSA
21.7 Ų
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
22

SMILES CN1CCC2=CC(=C(C3=C2C1=CC4=CC=CC=C43)OC)OC

Computed descriptors from PubChem (CID 821347), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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