Vitas-M small molecule compound
1-cycloheptyl-7-hydroxy-4-(4-hydroxy-3,5-dimethoxyphenyl)-1,2-dihydro-3H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-3-one
Catalog ID
STL521352
SMILES COc1cc(cc(c1O)OC)c1c2c(=O)[nH]n(c2nc2c1oc1c2ccc(c1)O)C1CCCCCC1
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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 C27H27N3O6 MW 489.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O6/c1-34-19-11-14(12-20(35-2)24(19)32)21-22-26(30(29-27(22)33)15-7-5-3-4-6-8-15)28-23-17-10-9-16(31)13-18(17)36-25(21)23/h9-13,15,31-32H,3-8H2,1-2H3,(H,29,33)InChIKey
RPPXYJPJLWFFOH-UHFFFAOYSA-NSynonyms
1cycloheptyl7hydroxy4(4hydroxy35dimethoxyphenyl)12dihydro3H(1)benzofuro(32b)pyrazolo(43e)pyridin3one
1cycloheptyl7hydroxy4(4hydroxy35dimethoxyphenyl)1Hbenzofuro(32b)pyrazolo(43e)pyridin3(2H)one
COc1cc(cc(c1O)OC)c1c2c(=O)(nH)n(c2nc2c1oc1c2ccc(c1)O)C1CCCCCC1
InChI=1SC27H27N3O6c134191114(1220(352)24(19)32)212226(30(2927(22)33)1575346815)28231710916(31)1318(17)3625(21)23h913153132H38H212H3(H2933)
MFCD22574554
ZINC000079191732
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