Vitas-M small molecule compound
[9-(4-methoxyphenyl)-6-oxo-6,9-dihydro-1H-purin-1-yl]acetic acid
Catalog ID
STK351040
SMILES COc1ccc(cc1)n1cnc2c1ncn(c2=O)CC(=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C14H12N4O4 MW 300.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N4O4/c1-22-10-4-2-9(3-5-10)18-8-15-12-13(18)16-7-17(14(12)21)6-11(19)20/h2-5,7-8H,6H2,1H3,(H,19,20)InChIKey
LSFCIDAFGLNMTC-UHFFFAOYSA-NSynonyms
937599-53-6(9(4methoxyphenyl)6oxo69dihydro1Hpurin1yl)aceticacid
2(9(4METHOXYPHENYL)6OXOHYDROPURINYL)ACETICACID
2(9(4methoxyphenyl)6oxopurin1yl)aceticacid
937599536
COC1=CC=C(C=C1)N2C=NC3=C2N=CN(C3=O)CC(=O)O
InChI=1SC14H12N4O4c12210429(3510)188151213(18)16717(14(12)21)611(19)20h2578H6H21H3(H1920)
MFCD08556214
ZINC000012394753
ZINC12394753
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