Formycin triphosphate

CAT: 0013-GTR19262553-02Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19262553-02Size:10 mg

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Description

Formycin triphosphate is a fluorescent analog of ATP, exhibiting enhanced fluorescence when binding to enzyme active sites. It acts as a competitive inhibitor of avian liver pyruvate carboxylase (pyruvate carboxylase) . Additionally, formycin triphosphate increases atrial natriuretic factor (ANF) -stimulated guanylate cyclase activity with an EC50 of approximately 90 μM and inhibits ATP-stimulated guanylate cyclase activity with an IC50 of around 100 μM.

CAS Number

16409-13-5

Field of Research

Pharmacology & Drug Discovery

Smiles

O[C@H]1[C@H] (C=2C=3C (NN2) =C (N) N=CN3) O[C@H] (COP (OP (OP (=O) (O) O) (=O) O) (=O) O) [C@H]1O

Molecular Formula

C10H16N5O13P3

Molecular Weight

507.18

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

Formycin triphosphate

formycin ATP analog

CAS Number	16409-13-5
PubChem CID	72941511
IUPAC Name	[[(2R,3S,4R,5S)-5-(7-amino-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Molecular Formula	C10H16N5O13P3
Molecular Weight	507.18
XLogP	-6.1
Topological Polar Surface Area	290
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	17
Rotatable Bond Count	8
Heavy Atom Count	31
Formal Charge	0
Complexity	800

SMILES

C1=NC2=C(NN=C2C(=N1)N)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O

InChI

InChI=1S/C10H16N5O13P3/c11-10-6-4(12-2-13-10)5(14-15-6)9-8(17)7(16)3(26-9)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-3,7-9,16-17H,1H2,(H,14,15)(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/t3-,7-,8-,9+/m1/s1

InChIKey

DCMOKHVROIRMGQ-KSYZLYKTSA-N

Chemical Structure

2D Structure

CAS: 16409-13-5

CID: 72941511

Formula: C10H16N5O13P3

MW: 507.18

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	507.18
XLogP3	-6.1
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	17
Rotatable Bond Count	8
Exact Mass	506.99574658
Monoisotopic Mass	506.99574658
Topological Polar Surface Area	290 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	800
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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