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Chemical structure of Crebanine

GC35747

Crebanine

Also known as 15,16-dimethoxy-11-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14(19),15,17-hexaene

Crebanine, an alkaloid from Stephania venosa, induces G1 arrest and apoptosis in human cancer cells

ChemicalCAS25127-29-1MW339.39FormulaC20H21NO4
CAS number
25127-29-1
Molecular weight
339.39
Formula
C20H21NO4
Solubility
DMSO ： 100 mg/mL (294·65 mM; Need ultrasonic)
InChIKey
UVDQDNQWGQFIAO-UHFFFAOYSA-N
Catalogue number
GC35747
Brand
GLPBIO
Computed properties PubChem CID 159999 · XLogP 3.2 · TPSA 40.2 Ų · H-bond donors 0
XLogP
3.2
TPSA
40.2 Ų
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
25

SMILES CN1CCC2=CC3=C(C4=C2C1CC5=C4C=CC(=C5OC)OC)OCO3

Computed descriptors from PubChem (CID 159999), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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