Vitas-M small molecule compound
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-6-propyl-4H-chromen-7-yl 3,4,5-trimethoxybenzoate
Catalog ID
STK888658
SMILES CCCc1cc2c(cc1OC(=O)c1cc(OC)c(c(c1)OC)OC)oc(c(c2=O)c1ccc2c(c1)OCCCO2)C
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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 C32H32O9 MW 560.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32O9/c1-6-8-19-13-22-25(17-24(19)41-32(34)21-15-27(35-3)31(37-5)28(16-21)36-4)40-18(2)29(30(22)33)20-9-10-23-26(14-20)39-12-7-11-38-23/h9-10,13-17H,6-8,11-12H2,1-5H3InChIKey
BGBFHAHPGLJWOH-UHFFFAOYSA-NSynonyms
618389-16-5(3(34DIHYDRO2H15BENZODIOXEPIN7YL)2METHYL4OXO6PROPYLCHROMEN7YL)345TRIMETHOXYBENZOATE
3(2H3H4HBENZO(B)14DIOXEPAN7YL)2METHYL4OXO6PROPYLCHROMEN7YL345TRIMETHOXYBENZOATE
3(34dihydro2H15benzodioxepin7yl)2methyl4oxo6propyl4Hchromen7yl345trimethoxybenzoate
3(34dihydro2Hbenzo(b)(14)dioxepin7yl)2methyl4oxo6propyl4Hchromen7yl345trimethoxybenzoate
618389165
CCCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCCO4)OC(=O)C5=CC(=C(C(=C5)OC)OC)OC
InChI=1SC32H32O9c16819132225(1724(19)4132(34)211527(353)31(375)28(1621)364)4018(2)29(30(22)33)209102326(1420)39127113823h9101317H681112H215H3
MFCD03854118
ZINC000002096180
ZINC2096180
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