Vitas-M small molecule compound
methyl 4-{[9-(1,3-benzodioxol-5-ylmethyl)-4-oxo-9,10-dihydro-4H,8H-chromeno[8,7-e][1,3]oxazin-3-yl]oxy}benzoate
Catalog ID
STK633320
SMILES COC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc1c2CN(CO1)Cc1ccc2c(c1)OCO2
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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 C27H21NO8 MW 487.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21NO8/c1-31-27(30)17-3-5-18(6-4-17)36-24-13-32-26-19(25(24)29)7-9-21-20(26)12-28(14-33-21)11-16-2-8-22-23(10-16)35-15-34-22/h2-10,13H,11-12,14-15H2,1H3InChIKey
GDOWHMJSZIMFNY-UHFFFAOYSA-NSynonyms
951936-69-9951936699
COC(=O)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC4=C3CN(CO4)CC5=CC6=C(C=C5)OCO6
InChI=1SC27H21NO8c13127(30)173518(6417)362413322619(25(24)29)792120(26)1228(143321)1116282223(1016)35153422h21013H11121415H21H3
methyl4((9(13benzodioxol5ylmethyl)4oxo810dihydropyrano(23f)(13)benzoxazin3yl)oxy)benzoate
methyl4((9(13benzodioxol5ylmethyl)4oxo910dihydro4H8Hchromeno(87e)(13)oxazin3yl)oxy)benzoate
methyl4((9(benzo(d)(13)dioxol5ylmethyl)4oxo48910tetrahydrochromeno(87e)(13)oxazin3yl)oxy)benzoate
METHYL4(9(2HBENZO(34D)13DIOXOLAN5YLMETHYL)4OXO8H10HCHROMENO(87E)13OXAZAPERHYDROIN3YLOXY)BENZOATE
MFCD09852386
ZINC000013691192
ZINC13691192
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