Vitas-M small molecule compound
methyl 2-amino-4-(1,3-benzodioxol-5-yl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Catalog ID
STK085566
SMILES COC(=O)C1=C(N)OC2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2
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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 C18H17NO6 MW 343.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO6/c1-22-18(21)16-14(9-5-6-11-13(7-9)24-8-23-11)15-10(20)3-2-4-12(15)25-17(16)19/h5-7,14H,2-4,8,19H2,1H3InChIKey
LKJPAWYTDDAKLF-UHFFFAOYSA-NSynonyms
612802-44-5612802445
COC(=O)C1=C(N)OC2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2
COC(=O)C1=C(OC2=C(C1C3=CC4=C(C=C3)OCO4)C(=O)CCC2)N
InChI=1SC18H17NO6c12218(21)1614(9561113(79)2482311)1510(20)32412(15)2517(16)19h5714H24819H21H3
methyl2amino4(13benzodioxol5yl)5oxo4678tetrahydrochromene3carboxylate
methyl2amino4(13benzodioxol5yl)5oxo5678tetrahydro4Hchromene3carboxylate
methyl2amino4(benzo(d)(13)dioxol5yl)5oxo5678tetrahydro4Hchromene3carboxylate
METHYL4(2HBENZO(34D)13DIOXOLEN5YL)2AMINO5OXO4H678TRIHYDROCHROMENE3CARBOXYLATE
MFCD03267365
STK085566
ZINC000000487749
ZINC000000487750
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