Vitas-M small molecule compound
1-cycloheptyl-6-hydroxy-4-(4-hydroxy-3,5-dimethoxyphenyl)-1,2,4,5-tetrahydro-3H-pyrazolo[3,4-b]pyridin-3-one
Catalog ID
STL151999
SMILES COc1cc(cc(c1O)OC)C1CC(=Nc2c1c(=O)[nH]n2C1CCCCCC1)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 C21H27N3O5 MW 401.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O5/c1-28-15-9-12(10-16(29-2)19(15)26)14-11-17(25)22-20-18(14)21(27)23-24(20)13-7-5-3-4-6-8-13/h9-10,13-14,26H,3-8,11H2,1-2H3,(H,22,25)(H,23,27)InChIKey
AKCKRVHGOGQYBF-UHFFFAOYSA-NSynonyms
1310935-74-01310935740
1cycloheptyl4(4hydroxy35dimethoxyphenyl)2457tetrahydropyrazolo(34b)pyridine36dione
1cycloheptyl6hydroxy4(4hydroxy35dimethoxyphenyl)1245tetrahydro3Hpyrazolo(34b)pyridin3one
COC1=CC(=CC(=C1O)OC)C2CC(=O)NC3=C2C(=O)NN3C4CCCCCC4
COc1cc(cc(c1O)OC)C1CC(=Nc2c1c(=O)(nH)n2C1CCCCCC1)O
InChI=1SC21H27N3O5c12815912(1016(292)19(15)26)141117(25)222018(14)21(27)2324(20)1375346813h910131426H3811H212H3(H2225)(H2327)
MFCD20756201
ZINC000071280257
ZINC000071280258
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