Determine the necessary mass, volume, or concentration for preparing a solution.
Activity Type | Activity Value -log(M) | Mechanism of Action | Activity Reference | Publications (PubMed IDs) |
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SKU | Size | Availability | Price | Qty |
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R129835-10mg | 10mg | In stock | $70.90 | |
R129835-50mg | 50mg | In stock | $272.90 | |
R129835-100mg | 100mg | In stock | $468.90 | |
R129835-250mg | 250mg | In stock | $1,055.90 | |
R129835-1g | 1g | In stock | $3,798.90 |
Potent antimetabolite antineoplastic agent. Selective thymidylate synthase inhibitor.
Synonyms | N-[(5-{methyl[(2-methyl-4-oxo-1,4-dihydroquinazolin-6-yl)methyl]amino}thiophen-2-yl)carbonyl]-L-glutamic acid | RALTITREXED [WHO-DD] | SMR000469217 | KS-5069 | Tox21_113366 | UNII-FCB9EGG971 | (S)-2-(5-(Methyl((2-methyl-4-oxo-3,4-dihydroquinazolin-6-yl)-m |
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Specifications & Purity | Moligand™, ≥98% |
Biochemical and Physiological Mechanisms | Raltitrexed is a folate-based inhibitor of thymidylate synthase (TS) that is rapidly and extensively metabolized to its more potent polyglutamate derivatives. Raltitrexed is an inhibitor of DHFR.Potent antimetabolite antineoplastic agent. Selective thymid |
Storage Temp | Store at -20°C |
Shipped In | Ice chest + Ice pads |
Grade | Moligand™ |
Action Type | INHIBITOR |
Mechanism of action | Thymidylate synthase inhibitor |
Note | Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details. |
Product Description | Raltitrexed is a thymidylate synthase inhibitor with an IC50 of 9 nM for the inhibition of L1210 cell growth. |
ALogP | 1.4 |
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Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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Pubchem Sid | 488202830 |
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Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488202830 |
IUPAC Name | (2S)-2-[[5-[methyl-[(2-methyl-4-oxo-3H-quinazolin-6-yl)methyl]amino]thiophene-2-carbonyl]amino]pentanedioic acid |
INCHI | InChI=1S/C21H22N4O6S/c1-11-22-14-4-3-12(9-13(14)19(28)23-11)10-25(2)17-7-6-16(32-17)20(29)24-15(21(30)31)5-8-18(26)27/h3-4,6-7,9,15H,5,8,10H2,1-2H3,(H,24,29)(H,26,27)(H,30,31)(H,22,23,28)/t15-/m0/s1 |
InChi Key | IVTVGDXNLFLDRM-HNNXBMFYSA-N |
Canonical SMILES | CC1=NC2=C(C=C(C=C2)CN(C)C3=CC=C(S3)C(=O)NC(CCC(=O)O)C(=O)O)C(=O)N1 |
Isomeric SMILES | CC1=NC2=C(C=C(C=C2)CN(C)C3=CC=C(S3)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N1 |
PubChem CID | 135400182 |
Molecular Weight | 458.49 |
ChEMBL Ligand | CHEMBL225071 |
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DrugBank Ligand | DB00293 |
PubChem CID | 135400182 |
CAS Registry No. | 112887-68-0 |
Wikipedia | Raltitrexed |
RCSB PDB Ligand | D16 |
DrugCentral Ligand | 2353 |
PubChem SID | 488202830 |
Enter Lot Number to search for COA:
Find and download the COA for your product by matching the lot number on the packaging.
Lot Number | Certificate Type | Date | Item |
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F1501137 | Certificate of Analysis | Oct 18, 2024 | R129835 |
F23251508 | Certificate of Analysis | Jun 02, 2023 | R129835 |
F23251526 | Certificate of Analysis | Jun 02, 2023 | R129835 |
F23251532 | Certificate of Analysis | Jun 02, 2023 | R129835 |
F23251533 | Certificate of Analysis | Jun 02, 2023 | R129835 |
F23251537 | Certificate of Analysis | Jun 02, 2023 | R129835 |
F23251542 | Certificate of Analysis | Jun 02, 2023 | R129835 |
F23251546 | Certificate of Analysis | Jun 02, 2023 | R129835 |
F23251549 | Certificate of Analysis | Jun 02, 2023 | R129835 |
Solubility | Soluble in water (<1 mg/ml at 25 °C), DMSO (92 mg/ml at 25 °C), methanol (warmed), and ethanol (<1 mg/ml at 25 °C). |
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Sensitivity | Heat Sensitive |
Specific Rotation[α] | -17° (C=1,MeOH) |
Melt Point(°C) | 176 °C(dec.) |
Pictogram(s) | GHS08 |
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Signal | Warning |
Hazard Statements | H341:Suspected of causing genetic defects H361:Suspected of damaging fertility or the unborn child |
Precautionary Statements | P280:Wear protective gloves/protective clothing/eye protection/face protection. P405:Store locked up. P501:Dispose of contents/container to ... P281:Use personal protective equipment as required. P203:Obtain, read and follow all safety instructions before use. P318:if exposed or concerned, get medical advice. |
Merck Index | 8099 |