Vitas-M small molecule compound
1-cycloheptyl-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
STL521287
SMILES COc1cc(cc(c1OC)OC)c1c2oc3c(c2nc2c1c(=O)[nH]n2C1CCCCCC1)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 C28H29N3O6 MW 503.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O6/c1-34-20-12-15(13-21(35-2)25(20)36-3)22-23-27(31(30-28(23)33)16-8-6-4-5-7-9-16)29-24-18-11-10-17(32)14-19(18)37-26(22)24/h10-14,16,32H,4-9H2,1-3H3,(H,30,33)InChIKey
TXKQCQYTEXKQIX-UHFFFAOYSA-NSynonyms
1cycloheptyl7hydroxy4(345trimethoxyphenyl)12dihydro3H(1)benzofuro(32b)pyrazolo(43e)pyridin3one
1cycloheptyl7hydroxy4(345trimethoxyphenyl)1Hbenzofuro(32b)pyrazolo(43e)pyridin3(2H)one
COc1cc(cc(c1OC)OC)c1c2oc3c(c2nc2c1c(=O)(nH)n2C1CCCCCC1)ccc(c3)O
InChI=1SC28H29N3O6c134201215(1321(352)25(20)363)222327(31(3028(23)33)1686457916)292418111017(32)1419(18)3726(22)24h10141632H49H213H3(H3033)
MFCD22574346
ZINC000079189458
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