Vitas-M small molecule compound
(7Z)-7-(1,3-benzodioxol-5-ylmethylidene)-9-methyl-3-(propan-2-yl)-3,4-dihydro-2H-furo[3,2-g][1,3]benzoxazin-6(7H)-one
Catalog ID
STK925729
SMILES CC(N1COc2c(C1)cc1c(c2C)O/C(=C\c2ccc3c(c2)OCO3)/C1=O)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 C22H21NO5 MW 379.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO5/c1-12(2)23-9-15-8-16-20(24)19(28-22(16)13(3)21(15)25-10-23)7-14-4-5-17-18(6-14)27-11-26-17/h4-8,12H,9-11H2,1-3H3/b19-7-InChIKey
IKNOHOSBAAMTNR-GXHLCREISA-NSynonyms
1011625-49-2(7Z)7(13benzodioxol5ylmethylidene)9methyl3(propan2yl)34dihydro2Hfuro(32g)(13)benzoxazin6(7H)one
(7Z)7(13benzodioxol5ylmethylidene)9methyl3propan2yl24dihydrofuro(32g)(13)benzoxazin6one
1011625492
CC(N1COc2c(C1)cc1c(c2C)OC(=Cc2ccc3c(c2)OCO3)C1=O)C
CC1=C2C(=CC3=C1OCN(C3)C(C)C)C(=O)C(=CC4=CC5=C(C=C4)OCO5)O2
InChI=1SC22H21NO5c112(2)2391581620(24)19(2822(16)13(3)21(15)251023)714451718(614)27112617h4812H911H213H3b197
MFCD10041393
ZINC000054313631
ZINC54313631
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