Vitas-M small molecule compound
9-(1,3-benzodioxol-5-ylmethyl)-3-benzyl-4-methyl-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Catalog ID
STK887618
SMILES O=c1oc2c3CN(COc3ccc2c(c1Cc1ccccc1)C)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 C27H23NO5 MW 441.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23NO5/c1-17-20-8-10-23-22(26(20)33-27(29)21(17)11-18-5-3-2-4-6-18)14-28(15-30-23)13-19-7-9-24-25(12-19)32-16-31-24/h2-10,12H,11,13-16H2,1H3InChIKey
OPEHEJPQOFQXTJ-UHFFFAOYSA-NSynonyms
858765-74-9858765749
9(13BENZODIOXOL5YLMETHYL)3BENZYL4METHYL810DIHYDROPYRANO(23F)(13)BENZOXAZIN2ONE
9(13benzodioxol5ylmethyl)3benzyl4methyl910dihydro2H8Hchromeno(87e)(13)oxazin2one
9(benzo(d)(13)dioxol5ylmethyl)3benzyl4methyl910dihydrochromeno(87e)(13)oxazin2(8H)one
CC1=C(C(=O)OC2=C1C=CC3=C2CN(CO3)CC4=CC5=C(C=C4)OCO5)CC6=CC=CC=C6
InChI=1SC27H23NO5c117208102322(26(20)3327(29)21(17)11185324618)1428(153023)1319792425(1219)32163124h21012H111316H21H3
MFCD04143994
ZINC000055393774
ZINC55393774
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