Pteridines and derivatives

Aminopterin Hydrate

Grade & Purity:

≥98%

Cas Number: 54-62-6 EC Number: 200-209-9

Formula: C₁₉H₂₀N₈O₅·xH₂O Molecular Weight: 440.41(as Anhydrous)

IUPAC Name: (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid

SMILES: Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2n1

InChIKey: TVZGACDUOSZQKY-LBPRGKRZSA-N

InChI: InChI=1S/C19H20N8O5/c20-15-14-16(27-19(21)26-15)23-8-11(24-14)7-22-10-3-1-9(2-4-10)17(30)25-12(18(31)32)5-6-13(28)29/h1-4,8,12,22H,5-7H2,(H,25,30)(H,2show more

Synonyms: CAS-54-62-6 | Kyselina N-(p-((2,4-diamino-6-pteridinylmethyl)amino)benzoyl)-L(+)-glutamova | (2S)-2-[[4-[[(2,4-Diamin...

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Lumazine

Grade & Purity:

≥99%

Cas Number: 487-21-8

Formula: C₆H₄N₄O₂ Molecular Weight: 164.12

IUPAC Name: 1H-pteridine-2,4-dione

SMILES: C1=CN=C2C(=N1)C(=O)NC(=O)N2

InChIKey: UYEUUXMDVNYCAM-UHFFFAOYSA-N

InChI: InChI=1S/C6H4N4O2/c11-5-3-4(8-2-1-7-3)9-6(12)10-5/h1-2H,(H2,8,9,10,11,12)

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Pterine

Grade & Purity:

≥95%

Cas Number: 2236-60-4 Compound CID: 135398660

Formula: C₆H₅N₅O Molecular Weight: 163.14

IUPAC Name: 2-amino-3H-pteridin-4-one

SMILES: C1=CN=C2C(=N1)C(=O)NC(=N2)N

InChIKey: HNXQXTQTPAJEJL-UHFFFAOYSA-N

InChI: InChI=1S/C6H5N5O/c7-6-10-4-3(5(12)11-6)8-1-2-9-4/h1-2H,(H3,7,9,10,11,12)

Synonyms: 2-Aminopteridin-4-one | 2-Amino-1H-pteridin-4-one | NSC18696 | NSC-18696 | UNII-85MA24E1NH | 2-desaminoaminopterin | ...

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Methotrexate hydrate

Grade & Purity:

≥99%

Cas Number: 133073-73-1 Compound CID: 165528

Formula: C₂₀H₂₂N₈O₅·xH₂O Molecular Weight: 454.44 (anhydrous basis)

IUPAC Name: (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid;hydrate

SMILES: CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O.O

InChIKey: FPJYMUQSRFJSEW-ZOWNYOTGSA-N

InChI: InChI=1S/C20H22N8O5.H2O/c1-28(9-11-8-23-17-15(24-11)16(21)26-20(22)27-17)12-4-2-10(3-5-12)18(31)25-13(19(32)33)6-7-14(29)30;/h2-5,8,13H,6-7,9H2,1H3,(Hshow more

Synonyms: Methotrexate hydrate, Vetec(TM) reagent grade, 98% | Methotrexate hydrate(1:x) | Methotrexate xhydrate | METHOTREXATE...

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Volasertib (BI 6727)

Grade & Purity:

Moligand™

≥97%

Cas Number: 755038-65-4 Compound CID: 10461508

Formula: C₃₄H₅₀N₈O₃ Molecular Weight: 618.83

IUPAC Name: N-[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]-4-[[(7R)-7-ethyl-5-methyl-6-oxo-8-propan-2-yl-7H-pteridin-2-yl]amino]-3-methoxybenzamide

SMILES: CCC1C(=O)N(C2=CN=C(N=C2N1C(C)C)NC3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N5CCN(CC5)CC6CC6)OC)C

InChIKey: SXNJFOWDRLKDSF-XKHVUIRMSA-N

InChI: InChI=1S/C34H50N8O3/c1-6-28-33(44)39(4)29-20-35-34(38-31(29)42(28)22(2)3)37-27-14-9-24(19-30(27)45-5)32(43)36-25-10-12-26(13-11-25)41-17-15-40(16-18-4show more

Synonyms: BCPP000341 | DTXSID901025694 | Benzamide, N-(trans-4-(4-(cyclopropylmethyl)-1-piperazinyl)cyclohexyl)-4-(((7R)-7-ethy...

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6-(Bromomethyl)-2,4-pteridinediamine hydrobromide

Grade & Purity:

≥90%

Cas Number: 52853-40-4 Compound CID: 12503242

Formula: C₇H₇BrN₆BrH Molecular Weight: 335.99

IUPAC Name: 6-(bromomethyl)pteridine-2,4-diamine;hydrobromide

SMILES: C1=C(N=C2C(=NC(=NC2=N1)N)N)CBr.Br

InChIKey: KMQIBGKVZDBGAH-UHFFFAOYSA-N

InChI: InChI=1S/C7H7BrN6.BrH/c8-1-3-2-11-6-4(12-3)5(9)13-7(10)14-6;/h2H,1H2,(H4,9,10,11,13,14);1H

Synonyms: 52853-40-4|6-(bromomethyl)pteridine-2,4-diamine hydrobromide|6-Bromomethyl-pteridine-2,4-diamine HBr|6-(bromomethyl)-...

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BI 2536

Grade & Purity:

Moligand™

≥98%

Cas Number: 755038-02-9

Formula: C₂₈H₃₉N₇O₃ Molecular Weight: 521.66

IUPAC Name: 4-[[(7R)-8-cyclopentyl-7-ethyl-5-methyl-6-oxo-7H-pteridin-2-yl]amino]-3-methoxy-N-(1-methylpiperidin-4-yl)benzamide

SMILES: CCC1C(=O)N(C2=CN=C(N=C2N1C3CCCC3)NC4=C(C=C(C=C4)C(=O)NC5CCN(CC5)C)OC)C

InChIKey: XQVVPGYIWAGRNI-JOCHJYFZSA-N

InChI: InChI=1S/C28H39N7O3/c1-5-22-27(37)34(3)23-17-29-28(32-25(23)35(22)20-8-6-7-9-20)31-21-11-10-18(16-24(21)38-4)26(36)30-19-12-14-33(2)15-13-19/h10-11,16show more

Synonyms: (R)-4-(8-cyclopentyl-7-ethyl-5-methyl-6-oxo-5,6,7,8-tetrahydropteridin-2-ylamino)-3-methoxy-N-(1-methylpiperidin-4-yl...

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6-Biopterin

Grade & Purity:

≥97%

Cas Number: 22150-76-1 EC Number: 244-807-8

Formula: C₉H₁₁N₅O₃ Molecular Weight: 237.22

IUPAC Name: 2-amino-6-[(1R,2S)-1,2-dihydroxypropyl]-3H-pteridin-4-one

SMILES: CC(C(C1=CN=C2C(=N1)C(=O)NC(=N2)N)O)O

InChIKey: LHQIJBMDNUYRAM-DZSWIPIPSA-N

InChI: InChI=1S/C9H11N5O3/c1-3(15)6(16)4-2-11-7-5(12-4)8(17)14-9(10)13-7/h2-3,6,15-16H,1H3,(H3,10,11,13,14,17)/t3-,6-/m0/s1

Synonyms: 2-amino-6-((1R,2S)-1,2-dihydroxypropyl)pteridin-4(1H)-one | DB05974 | AI3-24649 | (S-(R*,S*))-2-Amino-6-(1,2-dihydrox...

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SD-208

Grade & Purity:

Moligand™

≥98%

Cas Number: 627536-09-8 Compound CID: 10316032

Formula: C₁₇H₁₀ClFN₆ Molecular Weight: 352.75

IUPAC Name: 2-(5-chloro-2-fluorophenyl)-N-pyridin-4-ylpteridin-4-amine

SMILES: C1=CC(=C(C=C1Cl)C2=NC3=NC=CN=C3C(=N2)NC4=CC=NC=C4)F

InChIKey: BERLXWPRSBJFHO-UHFFFAOYSA-N

InChI: InChI=1S/C17H10ClFN6/c18-10-1-2-13(19)12(9-10)15-24-16-14(21-7-8-22-16)17(25-15)23-11-3-5-20-6-4-11/h1-9H,(H,20,22,23,24,25)

Synonyms: 2-(5-chloro-2-fluorophenyl)-4-(4-pyridylamino)pteridine | BCP02214 | FT-0700345 | HMS3604B06 | 1608481-61-3 | 2-(5-Ch...

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Riboflavine

Grade & Purity:

Moligand™

≥98%

Cas Number: 83-88-5 EC Number: 201-507-1 Compound CID: 493570

Formula: C₁₇H₂₀N₄O₆ Molecular Weight: 376.36

IUPAC Name: 7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4-dione

SMILES: CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(CO)O)O)O

InChIKey: AUNGANRZJHBGPY-SCRDCRAPSA-N

InChI: InChI=1S/C17H20N4O6/c1-7-3-9-10(4-8(7)2)21(5-11(23)14(25)12(24)6-22)15-13(18-9)16(26)20-17(27)19-15/h3-4,11-12,14,22-25H,5-6H2,1-2H3,(H,20,26,27)/t11-show more

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Riboflavin Tetrabutyrate

Grade & Purity:

≥98%(HPLC)

Cas Number: 752-56-7 Compound CID: 92140

Formula: C₃₃H₄₄N₄O₁₀ Molecular Weight: 656.73

IUPAC Name: [(2R,3S,4S)-2,3,4-tri(butanoyloxy)-5-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)pentyl] butanoate

SMILES: CCCC(=O)OCC(C(C(CN1C2=C(C=C(C(=C2)C)C)N=C3C1=NC(=O)NC3=O)OC(=O)CCC)OC(=O)CCC)OC(=O)CCC

InChIKey: MJNIWUJSIGSWKK-BBANNHEPSA-N

InChI: InChI=1S/C33H44N4O10/c1-7-11-25(38)44-18-24(46-27(40)13-9-3)30(47-28(41)14-10-4)23(45-26(39)12-8-2)17-37-22-16-20(6)19(5)15-21(22)34-29-31(37)35-33(43show more

Synonyms: RIBOFLAVIN TETRABUTYRATE [INCI] | Vitamin B2 tetrabutyrate | (+)-Antibiotic K 252a | RIBOFLAVIN 2', 3', 4', 5'-TETRAB...

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SCR7 pyrazine

Grade & Purity:

≥98%(HPLC)

Cas Number: 14892-97-8 Compound CID: 10688007

Formula: C₁₈H₁₂N₄OS Molecular Weight: 332.38

IUPAC Name: 6,7-diphenyl-2-sulfanylidene-1H-pteridin-4-one

SMILES: C1=CC=C(C=C1)C2=NC3=C(NC(=S)NC3=O)N=C2C4=CC=CC=C4

InChIKey: GSRTWXVBHGOUBU-UHFFFAOYSA-N

InChI: InChI=1S/C18H12N4OS/c23-17-15-16(21-18(24)22-17)20-14(12-9-5-2-6-10-12)13(19-15)11-7-3-1-4-8-11/h1-10H,(H2,20,21,22,23,24)

Synonyms: SCR7 pyrazine, >=98% (HPLC) | HY-107845 | Z3244609139 | 6,7-diphenyl-2-thioxo-2,3-dihydropteridin-4(1H)-one | AKOS025...

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Pteridines and derivatives

Description:

Ancestors: