Vitas-M small molecule compound
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-7H-furo[3,2-g]chromen-7-one
Catalog ID
STL467651
SMILES O=c1cc(C)c2c(o1)cc1c(c2)c(co1)c1ccc2c(c1)OCCCO2
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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 C21H16O5 MW 348.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16O5/c1-12-7-21(22)26-19-10-18-15(9-14(12)19)16(11-25-18)13-3-4-17-20(8-13)24-6-2-5-23-17/h3-4,7-11H,2,5-6H2,1H3InChIKey
UQINBEKYHKSEDT-UHFFFAOYSA-NSynonyms
1190294-44-01190294440
3(34dihydro2H15benzodioxepin7yl)5methyl7Hfuro(32g)chromen7one
3(34dihydro2H15benzodioxepin7yl)5methylfuro(32g)chromen7one
3(34dihydro2Hbenzo(b)(14)dioxepin7yl)5methyl7Hfuro(32g)chromen7one
CC1=CC(=O)OC2=C1C=C3C(=C2)OC=C3C4=CC5=C(C=C4)OCCCO5
InChI=1SC21H16O5c112721(22)2619101815(914(12)19)16(112518)13341720(813)246252317h34711H256H21H3
MFCD13676946
ZINC000036369888
ZINC36369888
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