Details
Stereochemistry | ACHIRAL |
Molecular Formula | C7H8N6O |
Molecular Weight | 192.178 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
NC1=NC(N)=C2N=C(CO)C=NC2=N1
InChI
InChIKey=CYNARAWTVHQHDI-UHFFFAOYSA-N
InChI=1S/C7H8N6O/c8-5-4-6(13-7(9)12-5)10-1-3(2-14)11-4/h1,14H,2H2,(H4,8,9,10,12,13)
Molecular Formula | C7H8N6O |
Molecular Weight | 192.178 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
PubMed
Title | Date | PubMed |
---|---|---|
Virtual combinatorial syntheses and computational screening of new potential anti-herpes compounds. | 1999 Aug 26 |
|
Design, synthesis, computational prediction, and biological evaluation of ester soft drugs as inhibitors of dihydrofolate reductase from Pneumocystis carinii. | 2001 Jul 19 |
|
Photohydrolysis of methotrexate produces pteridine, which induces poly-G-specific DNA damage through photoinduced electron transfer. | 2002 Nov |
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Determination of the chiral and achiral related substances of methotrexate by cyclodextrin-modified micellar electrokinetic chromatography. | 2004 Aug |
|
Prediction of genotoxicity of chemical compounds by statistical learning methods. | 2005 Jun |
|
Plasmodium berghei: lack of antimalarial activity of an analogue of folate precursor, 2,4-diamino-6-hydroxymethylpteridine in a mouse model. | 2008 Nov |
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 08:04:57 GMT 2023
by
admin
on
Sat Dec 16 08:04:57 GMT 2023
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Record UNII |
1RU16O4RO0
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Record Status |
Validated (UNII)
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Record Version |
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945-24-4
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1RU16O4RO0
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70347
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213-412-2
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