Vitas-M small molecule compound
1-cyclooctyl-4-(3,4-dihydroxyphenyl)-7-hydroxy-1,2-dihydro-3H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-3-one
Catalog ID
STL521526
SMILES Oc1ccc2c(c1)oc1c2nc2c(c1c1ccc(c(c1)O)O)c(=O)[nH]n2C1CCCCCCC1
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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 C26H25N3O5 MW 459.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O5/c30-16-9-10-17-20(13-16)34-24-21(14-8-11-18(31)19(32)12-14)22-25(27-23(17)24)29(28-26(22)33)15-6-4-2-1-3-5-7-15/h8-13,15,30-32H,1-7H2,(H,28,33)InChIKey
TWNOMKYWBKMXGS-UHFFFAOYSA-NSynonyms
1cyclooctyl4(34dihydroxyphenyl)7hydroxy12dihydro3H(1)benzofuro(32b)pyrazolo(43e)pyridin3one
1cyclooctyl4(34dihydroxyphenyl)7hydroxy1Hbenzofuro(32b)pyrazolo(43e)pyridin3(2H)one
InChI=1SC26H25N3O5c30169101720(1316)342421(1481118(31)19(32)1214)2225(2723(17)24)29(2826(22)33)15642135715h813153032H17H2(H2833)
MFCD22574419
Oc1ccc2c(c1)oc1c2nc2c(c1c1ccc(c(c1)O)O)c(=O)(nH)n2C1CCCCCCC1
ZINC000079190198
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