Vitas-M small molecule compound
1-cyclooctyl-7-hydroxy-4-(3-hydroxy-4-methoxyphenyl)-1,2-dihydro-3H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-3-one
Catalog ID
STL521564
SMILES COc1ccc(cc1O)c1c2c(=O)[nH]n(c2nc2c1oc1c2ccc(c1)O)C1CCCCCCC1
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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 C27H27N3O5 MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O5/c1-34-20-12-9-15(13-19(20)32)22-23-26(28-24-18-11-10-17(31)14-21(18)35-25(22)24)30(29-27(23)33)16-7-5-3-2-4-6-8-16/h9-14,16,31-32H,2-8H2,1H3,(H,29,33)InChIKey
RSZKNKLJNNSYNR-UHFFFAOYSA-NSynonyms
1cyclooctyl7hydroxy4(3hydroxy4methoxyphenyl)12dihydro3H(1)benzofuro(32b)pyrazolo(43e)pyridin3one
1cyclooctyl7hydroxy4(3hydroxy4methoxyphenyl)1Hbenzofuro(32b)pyrazolo(43e)pyridin3(2H)one
COc1ccc(cc1O)c1c2c(=O)(nH)n(c2nc2c1oc1c2ccc(c1)O)C1CCCCCCC1
InChI=1SC27H27N3O5c1342012915(1319(20)32)222326(282418111017(31)1421(18)3525(22)24)30(2927(23)33)16753246816h914163132H28H21H3(H2933)
MFCD22574407
ZINC000079190069
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