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NK314

CAT: 0931-T69936-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T69936-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
208237-49-4
Target
Topoisomerase, Others
Related Pathways
DNA Damage/DNA Repair, Others
Bioactivity
NK314 is a novel synthetic benzo[c]phenanthridine alkaloid that shows strong antitumor activity. It inhibited topoisomerase II activity and stabilized topoisomerase II-DNA cleavable complexes. The DNA breaks occurred within 1h after treatment with NK314 even without digestion of topoisomerase II by proteinase K, whereas etoposide required digestion of the enzyme protein in cleavable complex to detect DNA breaks. Pretreatment with topoisomerase II catalytic inhibitors, ICRF-193 and suramin, reduced both cleavable complex-mediated DNA breaks and proteinase K-independent DNA breaks, but protease inhibitors and nuclease inhibitors only decreased the latter.
Smiles
[Cl-].COc1ccc2c(c3CCC[n+]3c3c4cc5OCOc5cc4ccc23)c1O
Molecular Formula
C22H20ClNO4
Molecular Weight
397.85
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

NK-314

a benzo[c]phenanthridine that inhibits topoisomerase IIalpha and G2 cell cycle arrest; structure in first source

CAS Number208237-49-4
PubChem CID156596431
IUPAC Name12-methoxy-5,7-dioxa-24-azoniahexacyclo[11.11.0.02,10.04,8.014,19.020,24]tetracosa-1(13),2,4(8),9,11,14,19,21,23-nonaen-15-ol chloride
Molecular FormulaC22H18ClNO4
Molecular Weight395.8
Topological Polar Surface Area50.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count28
Formal Charge0
Complexity794
SMILES
COC1=CC2=CC3=C(C=C2C4=C1C5=C(CCCC5=C6[N+]4=CC=C6)O)OCO3.[Cl-]
InChI
InChI=1S/C22H17NO4.ClH/c1-25-19-9-12-8-17-18(27-11-26-17)10-14(12)22-21(19)20-13(4-2-6-16(20)24)15-5-3-7-23(15)22;/h3,5,7-10H,2,4,6,11H2,1H3;1H
InChIKey
BRFDCAFDRFHEKX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of NK-314
CAS: 208237-49-4
CID: 156596431
Formula: C22H18ClNO4
MW: 395.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight395.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass395.0924357
Monoisotopic Mass395.0924357
Topological Polar Surface Area50.9 Ų
Heavy Atom Count28
Formal Charge0
Complexity794
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS3840139-01NK314
A13993-25NK314 25mg
A13993-10NK314 10mg
A13993-100NK314 100mg
A13993-50NK314 50mg
A13993-5NK314 Topoisomerase II inhibitor 5mg

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