Vitas-M small molecule compound
3-hexyl-4,8-dimethyl-7-[2-(naphthalen-2-yl)-2-oxoethoxy]-2H-chromen-2-one
Catalog ID
STL464648
SMILES CCCCCCc1c(=O)oc2c(c1C)ccc(c2C)OCC(=O)c1ccc2c(c1)cccc2
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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 C29H30O4 MW 442.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30O4/c1-4-5-6-7-12-25-19(2)24-15-16-27(20(3)28(24)33-29(25)31)32-18-26(30)23-14-13-21-10-8-9-11-22(21)17-23/h8-11,13-17H,4-7,12,18H2,1-3H3InChIKey
HVQNPVDNBMMMQD-UHFFFAOYSA-NSynonyms
670244-56-13hexyl48dimethyl7(2(naphthalen2yl)2oxoethoxy)2Hchromen2one
3HEXYL48DIMETHYL7(2NAPHTHALEN2YL2OXOETHOXY)CHROMEN2ONE
670244561
CCCCCCC1=C(C2=C(C(=C(C=C2)OCC(=O)C3=CC4=CC=CC=C4C=C3)C)OC1=O)C
InChI=1SC29H30O4c14567122519(2)24151627(20(3)28(24)3329(25)31)321826(30)2314132110891122(21)1723h8111317H471218H213H3
MFCD03661287
ZINC000009033725
ZINC09033725
ZINC9033725
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