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Echiguanine A

CAT: 0013-GTR19240738-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19240738-02Size:10 mg
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Description
Echiguanine A is a Streptomyces-derived small molecule that potently inhibits phosphatidylinositol kinase. This inhibitor is a valuable research tool for studying PI3K signaling pathways in both cellular and biochemical assays.
CAS Number
137319-25-6
Smiles
O=C1N=C (N) NC=2NC=C (C (=O) NCCC (=N) N) C12
Molecular Formula
C10H13N7O2
Molecular Weight
263.26
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Echiguanine A

structure given in first source; isolated from Streptomyces; very potent inhibitor of phosphatidylinositol kinase

CAS Number137319-25-6
PubChem CID135492350
IUPAC Name2-amino-N-(3-amino-3-iminopropyl)-4-oxo-3,7-dihydropyrrolo[2,3-d]pyrimidine-5-carboxamide
Molecular FormulaC10H13N7O2
Molecular Weight263.26
XLogP-2.5
Topological Polar Surface Area162
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count19
Formal Charge0
Complexity447
SMILES
C1=C(C2=C(N1)N=C(NC2=O)N)C(=O)NCCC(=N)N
InChI
InChI=1S/C10H13N7O2/c11-5(12)1-2-14-8(18)4-3-15-7-6(4)9(19)17-10(13)16-7/h3H,1-2H2,(H3,11,12)(H,14,18)(H4,13,15,16,17,19)
InChIKey
APPZNNNSVGCTRW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Echiguanine A
CAS: 137319-25-6
CID: 135492350
Formula: C10H13N7O2
MW: 263.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight263.26
XLogP3-2.5
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass263.11307268
Monoisotopic Mass263.11307268
Topological Polar Surface Area162 Ų
Heavy Atom Count19
Formal Charge0
Complexity447
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
TN8380-01Echiguanine A
T202821-01Echiguanine B

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