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Imidazopyrimidines

Organic heterocyclic compounds that contain an imidazole ring fused to a pyrimidine ring. Imidazole is five-membered ring with three carbon atoms and two nitrogen atoms; pyrimidine is a six-membered ring with four carbon atoms and two nitrogen atoms.

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1

Xanthine Monosodium Salt, MP Biomedicals

CAS: 1196-43-6 Molecular Formula: C5H3N4NaO2 Molecular Weight (g/mol): 174.10 MDL Number: MFCD00069699 InChI Key: HKDXLLDCXWUUKY-UHFFFAOYSA-M Synonym: xanthine sodium salt,xanthine, sodium salt,xanthate de sodium french,1h-purine-2,6-dione, 3,7-dihydro-, sodium salt,3,7-dihydro-1h-purine-2,6-dione sodium salt,3,7-dihydro-1h-purine-2,6-dione, sodium salt,xanthate de sodium,1h-purine-2,6-dione, 3,9-dihydro-, sodium salt 1:?,potassium 2-oxo-3,7-dihydropurin-6-olate,sodium 2-oxo-3,7-dihydropurin-6-olate PubChem CID: 23668765 IUPAC Name: sodium 2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-ide SMILES: [Na+].O=C1NC2=C(N=C[N-]2)C(=O)N1

PubChem CID 23668765
CAS 1196-43-6
Molecular Weight (g/mol) 174.10
MDL Number MFCD00069699
SMILES [Na+].O=C1NC2=C(N=C[N-]2)C(=O)N1
Synonym xanthine sodium salt,xanthine, sodium salt,xanthate de sodium french,1h-purine-2,6-dione, 3,7-dihydro-, sodium salt,3,7-dihydro-1h-purine-2,6-dione sodium salt,3,7-dihydro-1h-purine-2,6-dione, sodium salt,xanthate de sodium,1h-purine-2,6-dione, 3,9-dihydro-, sodium salt 1:?,potassium 2-oxo-3,7-dihydropurin-6-olate,sodium 2-oxo-3,7-dihydropurin-6-olate
IUPAC Name sodium 2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-ide
InChI Key HKDXLLDCXWUUKY-UHFFFAOYSA-M
Molecular Formula C5H3N4NaO2
2

Linaclotide Ammonium Salt, TRC

Molecular Formula: C59 H81 N15 O21 S6 . x(H3 N) Synonym: Linzess Ammonium Salt,11: PN: WO2008151257 SEQID: 55 claimed protein Ammonium Salt 13: PN: WO2008151257 SEQID: 57 claimed protein Ammonium Salt,18: PN: WO2015054500 SEQID: 72 claimed protein Ammonium Salt,1: PN: WO2014131024 SEQID: 55 claimed protein Ammonium Salt;1: PN: WO2015054500 SEQID: 55 claimed protein Ammonium Salt;2074: PN: US20090062207 SEQID: 3 claimed protein Ammonium Salt,3: PN: WO2015054500 SEQID: 57 claimed protein Ammonium Salt,40: PN: WO2010065751 SEQID: 55 claimed protein Ammonium Salt,42: PN: WO2010065751 SEQID: 57 claimed protein Ammonium Salt;55: PN: US20100152118 SEQID: 55 claimed protein Ammonium Salt,55: PN: WO2011069038 SEQID: 55 claimed sequence Ammonium Salt,55: PN: WO2012037380 SEQID: 55 unclaimed protein Ammonium Salt,55: PN: WO2015054649 SEQID SMILES: N.C[C@@H](O)C1NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@@H](N)CSSC[C@H](NC=O)C(=O)N[C@@H](CC(=O)N)C(=O)N3CCC[C@H]3C(=O)N[C@@H](C)C(=O)N2)C(=O)N[C@H](CCC(=O)O)C(=O)N[C@@H](Cc4ccc(O)cc4)C(=O)NCCSSC[C@H](NC(=O)CNC1=O)C(=O)N[C@@H](Cc5ccc(O)cc5)C(=O)O

SMILES N.C[C@@H](O)C1NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@@H](N)CSSC[C@H](NC=O)C(=O)N[C@@H](CC(=O)N)C(=O)N3CCC[C@H]3C(=O)N[C@@H](C)C(=O)N2)C(=O)N[C@H](CCC(=O)O)C(=O)N[C@@H](Cc4ccc(O)cc4)C(=O)NCCSSC[C@H](NC(=O)CNC1=O)C(=O)N[C@@H](Cc5ccc(O)cc5)C(=O)O
Synonym Linzess Ammonium Salt,11: PN: WO2008151257 SEQID: 55 claimed protein Ammonium Salt 13: PN: WO2008151257 SEQID: 57 claimed protein Ammonium Salt,18: PN: WO2015054500 SEQID: 72 claimed protein Ammonium Salt,1: PN: WO2014131024 SEQID: 55 claimed protein Ammonium Salt;1: PN: WO2015054500 SEQID: 55 claimed protein Ammonium Salt;2074: PN: US20090062207 SEQID: 3 claimed protein Ammonium Salt,3: PN: WO2015054500 SEQID: 57 claimed protein Ammonium Salt,40: PN: WO2010065751 SEQID: 55 claimed protein Ammonium Salt,42: PN: WO2010065751 SEQID: 57 claimed protein Ammonium Salt;55: PN: US20100152118 SEQID: 55 claimed protein Ammonium Salt,55: PN: WO2011069038 SEQID: 55 claimed sequence Ammonium Salt,55: PN: WO2012037380 SEQID: 55 unclaimed protein Ammonium Salt,55: PN: WO2015054649 SEQID
Molecular Formula C59 H81 N15 O21 S6 . x(H3 N)
3

MOC-POC Tenofovir Fumarate Salt (Mixture of Diastereomers), TRC

High-purity organic molecules and analytical standards, strategically delivered worldwide to empower innovation and commercial success.

Molecular Weight (g/mol) 607.46
InChI Formula InChI=1S/C17H26N5O10P.C4H4O4/c1-11(2)32-17(24)28-9-31-33(25,30-8-27-16(23)26-4)10-29-12(3)5-22-7-21-13-14(18)19-6-20-15(13)22;5-3(6)1-2-4(7)8/h6-7,11-12H,5,8-10H2,1-4H3,(H2,18,19,20);1-2H,(H,5,6)(H,7,8)/b;2-1+/t12-,33?;/m1./s1
Chemical Name or Material MOC-POC Tenofovir Fumarate Salt (mixture of diastereomers)
SMILES COC(=O)OCOP(=O)(CO[C@H](C)Cn1cnc2c(N)ncnc12)OCOC(=O)OC(C)C.OC(=O)\C=C\C(=O)O
Synonym 5-[[(1R)-2-(6-Amino-9H-purin-9-yl)-1-methylethoxy]methyl]-2,4,6,8-tetraoxa-5-phosphanonanedioic Acid (1-Methylethyl,methyl) Ester 5-Oxide Fumarate,MOC-POC PMPA Fumarate
Recommended Storage -20°C
IUPAC Name [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(methoxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;(E)-but-2-enedioic acid
Molecular Formula C17 H26 N5 O10 P . C4 H4 O4
Formula Weight 607.1527
4

Phytic acid dodecasodium hydrate, MedChemExpress

MedChemExpress Phytic acid (Inositol hexaphosphate) dodecasodium hydrate is a phosphorus storage compound of seeds and cereal grains.

ENCOMPASS_PREFERRED
5

2'-Deoxyadenosine-5'-triphosphate disodium salt, 98%, Thermo Scientific™

CAS: 74299-50-6 Molecular Formula: C10H14N5Na2O12P3 Molecular Weight (g/mol): 535.15 MDL Number: MFCD00080335 InChI Key: JEKDCIBJADJZSK-DZVPOJRENA-L Synonym: 2'-deoxyadenosine-5'-triphosphate disodium salt PubChem CID: 131674273 IUPAC Name: disodium;[[[(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] phosphate SMILES: [Na+].[Na+].NC1=C2N=CN([C@H]3C[C@H](O)[C@@H](COP(O)(=O)OP([O-])(=O)OP(O)([O-])=O)O3)C2=NC=N1

PubChem CID 131674273
CAS 74299-50-6
Molecular Weight (g/mol) 535.15
MDL Number MFCD00080335
SMILES [Na+].[Na+].NC1=C2N=CN([C@H]3C[C@H](O)[C@@H](COP(O)(=O)OP([O-])(=O)OP(O)([O-])=O)O3)C2=NC=N1
Synonym 2'-deoxyadenosine-5'-triphosphate disodium salt
IUPAC Name disodium;[[[(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] phosphate
InChI Key JEKDCIBJADJZSK-DZVPOJRENA-L
Molecular Formula C10H14N5Na2O12P3