Vitas-M small molecule compound
1-(2-hydroxyethyl)-7,9-dimethyl-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Catalog ID
STK768019
SMILES OCCN1N=C(Cn2c1nc1c2c(=O)n(c(=O)n1C)C)C12CC3CC(C2)CC(C1)C3
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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 C21H28N6O3 MW 412.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N6O3/c1-24-17-16(18(29)25(2)20(24)30)26-11-15(23-27(3-4-28)19(26)22-17)21-8-12-5-13(9-21)7-14(6-12)10-21/h12-14,28H,3-11H2,1-2H3InChIKey
GQAXLRYUMUNPLB-UHFFFAOYSA-NSynonyms
442658-28-81(2hydroxyethyl)79dimethyl3(tricyclo(3311~37~)dec1yl)14dihydro(124)triazino(34f)purine68(7H9H)dione
3((3R5R)adamantan1yl)1(2hydroxyethyl)79dimethyl79dihydro(124)triazino(34f)purine68(1H4H)dione
3(1ADAMANTYL)1(2HYDROXYETHYL)79DIMETHYL4HPURINO(87C)(124)TRIAZINE68DIONE
3ADAMANTANYL1(2HYDROXYETHYL)79DIMETHYL579TRIHYDRO4H124TRIAZINO(43H)PURINE68DIONE
442658288
CN1C2=C(C(=O)N(C1=O)C)N3CC(=NN(C3=N2)CCO)C45CC6CC(C4)CC(C6)C5
InChI=1SC21H28N6O3c1241716(18(29)25(2)20(24)30)261115(2327(3428)19(26)2217)21812513(921)714(612)1021h121428H311H212H3
MFCD03308406
ZINC000004284932
ZINC04284932
ZINC4284932
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