Vitas-M small molecule compound
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxo-6-propyl-4H-chromen-7-yl furan-2-carboxylate
Catalog ID
STK922977
SMILES CCCc1cc2c(cc1OC(=O)c1ccco1)occ(c2=O)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 C26H22O7 MW 446.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22O7/c1-2-5-17-12-18-23(14-22(17)33-26(28)21-6-3-9-30-21)32-15-19(25(18)27)16-7-8-20-24(13-16)31-11-4-10-29-20/h3,6-9,12-15H,2,4-5,10-11H2,1H3InChIKey
QIVDCGZGRINQRR-UHFFFAOYSA-NSynonyms
610752-61-9(3(34DIHYDRO2H15BENZODIOXEPIN7YL)4OXO6PROPYLCHROMEN7YL)FURAN2CARBOXYLATE
3(2H3H4HBENZO(B)14DIOXEPAN7YL)4OXO6PROPYLCHROMEN7YLFURAN2CARBOXYLATE
3(34dihydro2H15benzodioxepin7yl)4oxo6propyl4Hchromen7ylfuran2carboxylate
3(34DIHYDRO2HBENZO(B)(14)DIOXEPIN7YL)4OXO6PROPYL4HCHROMEN7YLFURAN2CARBOXYLATE
610752619
CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCCO4)OC(=O)C5=CC=CO5
InChI=1SC26H22O7c12517121823(1422(17)3326(28)216393021)321519(25(18)27)16782024(1316)31114102920h3691215H2451011H21H3
MFCD03851033
ZINC000001135543
ZINC01135543
ZINC1135543
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