Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-3,4,7,8,9,10-hexahydro-2H,6H-benzo[3,4]chromeno[8,7-e][1,3]oxazin-6-one
Catalog ID
STL516017
SMILES O=c1oc2c3CN(COc3ccc2c2c1CCCC2)c1ccc2c(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 C22H19NO5 MW 377.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19NO5/c24-22-16-4-2-1-3-14(16)15-6-8-18-17(21(15)28-22)10-23(11-25-18)13-5-7-19-20(9-13)27-12-26-19/h5-9H,1-4,10-12H2InChIKey
XYEDQINFXCALAS-UHFFFAOYSA-NSynonyms
859871-13-91773588
3(13benzodioxol5yl)2478910hexahydroisochromeno(34f)(13)benzoxazin6one
3(13benzodioxol5yl)3478910hexahydro2H6Hbenzo(34)chromeno(87e)(13)oxazin6one
3(benzo(d)(13)dioxol5yl)3478910hexahydrobenzo(34)chromeno(87e)(13)oxazin6(2H)one
859871139
InChI=1SC22H19NO5c242216421314(16)15681817(21(15)2822)1023(112518)13571920(913)27122619h59H141012H2
MFCD05674396
ZINC000002118821
ZINC2118821
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