CAS Number146464-95-1
Synonymspralatrexato; pralatrexatum; 10-Propargyl-10-deazaaminopterin; N-{4-[1-(2,4-Diamino-6-pteridinyl)-4-pentyn-2-yl]benzoyl}-L-glutamic acid; Folotyn; N-{4-[1-(2,4-Diaminopteridin-6-yl)pent-4-yn-2-yl]benzoyl}-L-glutamic acid; N-(4-(1-((2,4-Diamino-6-pteridinyl)methyl)-3-butynyl)benzoyl)-L-glutamic acid; (2S)-2-[[4-[1-(2,4-diaminopteridin-6-yl)pent-4-yn-2-yl]benzoyl]amino]pentanedioic acid; Pralatrexate
Molecular FormulaC23H23N7O5
Molecular Weight477.47
Purity≥98 (HPLC)%
Density1.5±0.1 g/cm3
Melting Point215 °C(dec.)
Appearancepowder
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 146464-95-1 |
| Catalog No. | 2A-9060081 |
| Chinese Name | 普拉曲沙 |
| Synonyms | pralatrexato; pralatrexatum; 10-Propargyl-10-deazaaminopterin; N-{4-[1-(2,4-Diamino-6-pteridinyl)-4-pentyn-2-yl]benzoyl}-L-glutamic acid; Folotyn; N-{4-[1-(2,4-Diaminopteridin-6-yl)pent-4-yn-2-yl]benzoyl}-L-glutamic acid; N-(4-(1-((2,4-Diamino-6-pteridinyl)methyl)-3-butynyl)benzoyl)-L-glutamic acid; (2S)-2-[[4-[1-(2,4-diaminopteridin-6-yl)pent-4-yn-2-yl]benzoyl]amino]pentanedioic acid; Pralatrexate |
| Molecular Formula | C23H23N7O5 |
| Molecular Weight | 477.47 |
| Purity | ≥98 (HPLC) |
| Density | 1.5±0.1 g/cm3 |
| Melting Point | 215 °C(dec.) |
| Appearance | powder |
| Water Solubility | Water solubility: insoluble; water solubility: 360 |
| Storage Condition | 0-10°C; avoid heating |
| Application | Pralatrexate (Folotyn) is a folic acid analog with an IC50 of < 300 nM for some cell lines. |
| MDL Number | MFCD00920897 |
| SMILES | O=C([C@@H](NC(C1=CC=C(C(CC(N=C23)=CN=C3N=C(N=C2N)N)CC#C)C=C1)=O)CCC(O)=O)O |
| InChI | 1S/C23H23N7O5/c1-2-3-14(10-15-11-26-20-18(27-15)19(24)29-23(25)30-20)12-4-6-13(7-5-12)21(33)28-16(22(34)35)8-9-17(31)32/h1,4-7,11,14,16H,3,8-10H2,(H,28,33)(H,31,32)(H,34,35)(H4,24,25,26,29,30)/t14?,16-/m0/s1 |
| InChI Key | OGSBUKJUDHAQEA-WMCAAGNKSA-N |
| NACRES Code | NA.77 |
| UNSPSC | 12352200 |
| MSDS | msds/60081_1_146464_95_1.pdf |
| Transport Info | Product Name: Pralatrexate |
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