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Spermine NONOate

CAT: 0804-HY-101394-01Size: 5 mgDry Ice: YesHazardous: No
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CAT#:0804-HY-101394-01Size:5 mg
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Description
Spermine NONOate is a complex of nitric oxide (NO) with spermine and acts as a NO donor. Spermine NONOate can be used for NO aqueous solutions preparing[1].
CAS Number
136587-13-8
UNSPSC
12352211
Target
NO Synthase
Type
Reference compound
Related Pathways
Immunology/Inflammation
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/spermine-nonoate.html
Purity
98.0
Solubility
H2O : ≥ 100 mg/mL
Smiles
NCCCNCCCCN(CCCN)N(O)N=O
Molecular Formula
C10H26N6O2
Molecular Weight
262.35
References & Citations
[1]A Ramamurthi , et al. Measurement and modeling of nitric oxide release rates for nitric oxide donors. Chem Res Toxicol. 1997 Apr;10 (4) :408-13.|[2]K Homer, et al. In vitro comparison of two NONOates (novel nitric oxide donors) on rat pulmonary arteries. Eur J Pharmacol. 1998 Aug 28;356 (1) :49-57.
Shipping Conditions
Dry Ice
Storage Conditions
-80°C, protect from light, stored under nitrogen
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Spermine NONOate
CAS Number136587-13-8
PubChem CID135412725
IUPAC Name(Z)-[3-aminopropyl-[4-(3-aminopropylamino)butyl]amino]-hydroxyimino-oxidoazanium
Molecular FormulaC10H26N6O2
Molecular Weight262.35
XLogP-0.4
Topological Polar Surface Area129
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count12
Heavy Atom Count18
Formal Charge0
Complexity215
SMILES
C(CCN(CCCN)/[N+](=N/O)/[O-])CNCCCN
InChI
InChI=1S/C10H26N6O2/c11-5-3-8-13-7-1-2-9-15(10-4-6-12)16(18)14-17/h13,17H,1-12H2/b16-14-
InChIKey
STVYBUMQUAJDER-PEZBUJJGSA-N
Chemical Structure
2D Structure
2D structure of Spermine NONOate
CAS: 136587-13-8
CID: 135412725
Formula: C10H26N6O2
MW: 262.35
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight262.35
XLogP3-0.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count12
Exact Mass262.21172409
Monoisotopic Mass262.21172409
Topological Polar Surface Area129 Ų
Heavy Atom Count18
Formal Charge0
Complexity215
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes