Vitas-M small molecule compound
3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-8-{[(2,2,6,6-tetramethylpiperidin-4-yl)ammonio]methyl}-2H-chromen-7-olate
Catalog ID
STK622750
SMILES COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2C[NH2+]C1CC(C)(C)NC(C1)(C)C)[O-]
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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 C23H32N2O5 MW 416.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32N2O5/c1-13-15-7-8-18(26)17(20(15)30-21(28)16(13)9-19(27)29-6)12-24-14-10-22(2,3)25-23(4,5)11-14/h7-8,14,24-26H,9-12H2,1-6H3InChIKey
SANUAVIPBDZNIR-UHFFFAOYSA-NSynonyms
3(2methoxy2oxoethyl)4methyl2oxo8(((2266tetramethylpiperidin4yl)ammonio)methyl)2Hchromen7olate
3(2methoxy2oxoethyl)4methyl2oxo8(((2266tetramethylpiperidin4yl)azaniumyl)methyl)chromen7olate
CC1=C(C(=O)OC2=C1C=CC(=C2C(NH2+)C3CC(NC(C3)(C)C)(C)C)(O))CC(=O)OC
COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2C(NH2+)C1CC(C)(C)NC(C1)(C)C)(O)
InChI=1SC23H32N2O5c113157818(26)17(20(15)3021(28)16(13)919(27)296)1224141022(23)2523(45)1114h78142426H912H216H3
MFCD08747207
ZINC000009305580
ZINC9305580
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