Vitas-M small molecule compound

methyl 5-{[(3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]methyl}furan-2-carboxylate

Catalog ID
STL459603
SMILES COC(=O)c1ccc(o1)COc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1

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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 C25H22O6 MW 418.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22O6/c1-15-19-10-12-21(29-14-18-9-11-22(30-18)25(27)28-3)16(2)23(19)31-24(26)20(15)13-17-7-5-4-6-8-17/h4-12H,13-14H2,1-3H3
InChIKey
SZQDWAPSJNTLLR-UHFFFAOYSA-N
Synonyms
376379-15-6
376379156
CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC3=CC=C(O3)C(=O)OC)CC4=CC=CC=C4
InChI=1SC25H22O6c11519101221(29141891122(3018)25(27)283)16(2)23(19)3124(26)20(15)13177546817h412H1314H213H3
methyl5(((3benzyl48dimethyl2oxo2Hchromen7yl)oxy)methyl)furan2carboxylate
METHYL5((3BENZYL48DIMETHYL2OXOCHROMEN7YL)OXYMETHYL)FURAN2CARBOXYLATE
MFCD02115532
ZINC000001150980
ZINC01150980
ZINC1150980

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Available files

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