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NCAO

CAT: 0013-GTR19239153-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19239153-03Size:100 mg
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Description
N-ω-chloroacetyl-L-ornithine (NCAO) is a potent, reversible competitive inhibitor of ornithine decarboxylase (ODC) with cytotoxic and antiproliferative effects in tumor cell lines (EC50 1-50.6 μM) . It induces apoptosis, inhibits migration in vitro, and shows significant antitumor efficacy in mouse models of solid and ascitic myeloma tumors, supporting its use in oncology research.
CAS Number
20584-81-0
Field of Research
Cell Biology
Smiles
C ([C@@H] (C (O) =O) N) CCNC (CCl) =O
Molecular Formula
C7H13ClN2O3
Molecular Weight
208.64
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-delta-chloroacetyl-L-ornithine

RN given refers to (L)-isomer

CAS Number20584-81-0
PubChem CID152308
IUPAC Name(2S)-2-amino-5-[(2-chloroacetyl)amino]pentanoic acid
Molecular FormulaC7H13ClN2O3
Molecular Weight208.64
XLogP-3.1
Topological Polar Surface Area92.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count13
Formal Charge0
Complexity187
SMILES
C(C[C@@H](C(=O)O)N)CNC(=O)CCl
InChI
InChI=1S/C7H13ClN2O3/c8-4-6(11)10-3-1-2-5(9)7(12)13/h5H,1-4,9H2,(H,10,11)(H,12,13)/t5-/m0/s1
InChIKey
YOHUBSGWLQBGKD-YFKPBYRVSA-N
Chemical Structure
2D Structure
2D structure of N-delta-chloroacetyl-L-ornithine
CAS: 20584-81-0
CID: 152308
Formula: C7H13ClN2O3
MW: 208.64
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight208.64
XLogP3-3.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass208.0614700
Monoisotopic Mass208.0614700
Topological Polar Surface Area92.4 Ų
Heavy Atom Count13
Formal Charge0
Complexity187
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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