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MB05032

CAT: 0931-T16020-05Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T16020-05Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
261365-11-1
Target
Others, Phosphatase
Related Pathways
Metabolism, Others
Purity
0.9966
Bioactivity
MB05032 is a potent fructose-, -bisphosphatase inhibitor that inhibits gluconeogenesis and reduces d-lactate-triggered ETosis.
Smiles
O=P(O)(O)C=1OC(=CC1)C=2N=C(SC2CC(C)C)N
Molecular Formula
C11H15N2O4PS
Molecular Weight
302.29
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Mb-05032
CAS Number261365-11-1
PubChem CID11289630
IUPAC Name[5-[2-amino-5-(2-methylpropyl)-1,3-thiazol-4-yl]furan-2-yl]phosphonic acid
Molecular FormulaC11H15N2O4PS
Molecular Weight302.29
XLogP1.4
Topological Polar Surface Area138
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count19
Formal Charge0
Complexity365
SMILES
CC(C)CC1=C(N=C(S1)N)C2=CC=C(O2)P(=O)(O)O
InChI
InChI=1S/C11H15N2O4PS/c1-6(2)5-8-10(13-11(12)19-8)7-3-4-9(17-7)18(14,15)16/h3-4,6H,5H2,1-2H3,(H2,12,13)(H2,14,15,16)
InChIKey
XJMYIJPPDSZOPN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mb-05032
CAS: 261365-11-1
CID: 11289630
Formula: C11H15N2O4PS
MW: 302.29
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight302.29
XLogP31.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass302.04901514
Monoisotopic Mass302.04901514
Topological Polar Surface Area138 Ų
Heavy Atom Count19
Formal Charge0
Complexity365
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