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Chemical structure of Xylopine

GC64127

Xylopine

Also known as (12R)-16-methoxy-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

Xylopine is an aporphine alkaloid with cytotoxic activity on cancer cells· Xylopine induces oxidative stress, causes G2/M cell cycle arrest and apoptosis in cancer cells

ChemicalCAS517-71-5MW295.33FormulaC18H17NO3
CAS number
517-71-5
Molecular weight
295.33
Formula
C18H17NO3
InChIKey
RFWCCZDSXIZJMF-CQSZACIVSA-N
Catalogue number
GC64127
Brand
GLPBIO
Computed properties PubChem CID 160503 · XLogP 2.8 · TPSA 39.7 Ų · H-bond donors 1
XLogP
2.8
TPSA
39.7 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
22

SMILES COC1=CC2=C(C=C1)C3=C4[C@@H](C2)NCCC4=CC5=C3OCO5

Computed descriptors from PubChem (CID 160503), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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