Vitas-M small molecule compound

3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,6-diethyl-7-hydroxy-4H-chromen-4-one

Catalog ID
STL522996
SMILES CCc1oc2cc(O)c(cc2c(=O)c1c1ccc2c(c1)OCCO2)CC

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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 C21H20O5 MW 352.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O5/c1-3-12-9-14-18(11-15(12)22)26-16(4-2)20(21(14)23)13-5-6-17-19(10-13)25-8-7-24-17/h5-6,9-11,22H,3-4,7-8H2,1-2H3
InChIKey
QAXBZZRFGZXCMY-UHFFFAOYSA-N
Synonyms
159647-63-9
159647639
3(23dihydro14benzodioxin6yl)26diethyl7hydroxy4Hchromen4one
3(23DIHYDRO14BENZODIOXIN6YL)26DIETHYL7HYDROXYCHROMEN4ONE
3(23DIHYDROBENZO(B)(14)DIOXIN6YL)26DIETHYL7HYDROXY4HCHROMEN4ONE
5538613
InChI=1SC21H20O5c131291418(1115(12)22)2616(42)20(21(14)23)13561719(1013)25872417h5691122H3478H212H3
MFCD00709993
ZINC000005961459
ZINC5961459

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.