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Aplodan

CAT: 0931-T20843-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T20843-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
6903-79-3
Target
Others
Related Pathways
Others
Purity
0.9987
Bioactivity
Aplodan (creatinol-O-phosphate) exhibits antiischemic and antiarrhythmic capacity and protective action on the cell membrane. Aplodan can be used in research on the ischemic heart or ischemic heart disease with persistent ventricular premature beats.
Smiles
CN(CCOP(O)(O)=O)C(N)=N
Molecular Formula
C4H12N3O4P
Molecular Weight
197.13
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Creatinolfosfate

Creatinolfosfate is a phosphoethanolamine.

CAS Number6903-79-3
PubChem CID23342
IUPAC Name2-[carbamimidoyl(methyl)amino]ethyl dihydrogen phosphate
Molecular FormulaC4H12N3O4P
Molecular Weight197.13
XLogP-2.5
Topological Polar Surface Area120
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count12
Formal Charge0
Complexity202
SMILES
CN(CCOP(=O)(O)O)C(=N)N
InChI
InChI=1S/C4H12N3O4P/c1-7(4(5)6)2-3-11-12(8,9)10/h2-3H2,1H3,(H3,5,6)(H2,8,9,10)
InChIKey
FOIPWTMKYXWFGC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Creatinolfosfate
CAS: 6903-79-3
CID: 23342
Formula: C4H12N3O4P
MW: 197.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight197.13
XLogP3-2.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass197.05654287
Monoisotopic Mass197.05654287
Topological Polar Surface Area120 Ų
Heavy Atom Count12
Formal Charge0
Complexity202
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
GTR19172388-01Aplodan

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