Vitas-M small molecule compound
1-cyclooctyl-7-hydroxy-4-(3,4,5-trimethoxyphenyl)-1,2-dihydro-3H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-3-one
Catalog ID
STL521333
SMILES COc1cc(cc(c1OC)OC)c1c2oc3c(c2nc2c1c(=O)[nH]n2C1CCCCCCC1)ccc(c3)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 C29H31N3O6 MW 517.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O6/c1-35-21-13-16(14-22(36-2)26(21)37-3)23-24-28(30-25-19-12-11-18(33)15-20(19)38-27(23)25)32(31-29(24)34)17-9-7-5-4-6-8-10-17/h11-15,17,33H,4-10H2,1-3H3,(H,31,34)InChIKey
HJSWWINUELNKII-UHFFFAOYSA-NSynonyms
1cyclooctyl7hydroxy4(345trimethoxyphenyl)12dihydro3H(1)benzofuro(32b)pyrazolo(43e)pyridin3one
1cyclooctyl7hydroxy4(345trimethoxyphenyl)1Hbenzofuro(32b)pyrazolo(43e)pyridin3(2H)one
COc1cc(cc(c1OC)OC)c1c2oc3c(c2nc2c1c(=O)(nH)n2C1CCCCCCC1)ccc(c3)O
InChI=1SC29H31N3O6c135211316(1422(362)26(21)373)232428(302519121118(33)1520(19)3827(23)25)32(3129(24)34)179754681017h11151733H410H213H3(H3134)
MFCD22574624
ZINC000079192606
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