Vitas-M small molecule compound

3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-7-(propan-2-yloxy)-2-propyl-4H-chromen-4-one

Catalog ID
STL566185
SMILES CCCc1oc2cc(OC(C)C)c(cc2c(=O)c1c1ccc2c(c1)OCCCO2)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 C26H30O5 MW 422.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30O5/c1-5-8-21-25(18-9-10-20-24(14-18)29-12-7-11-28-20)26(27)19-13-17(6-2)22(30-16(3)4)15-23(19)31-21/h9-10,13-16H,5-8,11-12H2,1-4H3
InChIKey
DHCRHJWVABIBQU-UHFFFAOYSA-N
Synonyms
180077-40-1
1714567
180077401
3(34dihydro2H15benzodioxepin7yl)6ethyl7(propan2yloxy)2propyl4Hchromen4one
3(34dihydro2H15benzodioxepin7yl)6ethyl7propan2yloxy2propylchromen4one
3(34DIHYDRO2HBENZO(B)(14)DIOXEPIN7YL)6ETHYL7ISOPROPOXY2PROPYL4HCHROMEN4ONE
InChI=1SC26H30O5c1582125(189102024(1418)29127112820)26(27)191317(62)22(3016(3)4)1523(19)3121h9101316H581112H214H3
MFCD00857447
ZINC000002029167

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Available files

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