Vitas-M small molecule compound
4-methyl-2-oxo-3-phenyl-8-(pyrrolidinium-1-ylmethyl)-2H-chromen-7-olate
Catalog ID
STK620369
SMILES [O-]c1ccc2c(c1C[NH+]1CCCC1)oc(=O)c(c2C)c1ccccc1
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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 C21H21NO3 MW 335.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO3/c1-14-16-9-10-18(23)17(13-22-11-5-6-12-22)20(16)25-21(24)19(14)15-7-3-2-4-8-15/h2-4,7-10,23H,5-6,11-13H2,1H3InChIKey
ZPJPRYUILNIJDN-UHFFFAOYSA-NSynonyms
887218-17-9(O)c1ccc2c(c1C(NH+)1CCCC1)oc(=O)c(c2C)c1ccccc1
4methyl2oxo3phenyl8(pyrrolidinium1ylmethyl)2Hchromen7olate
7HYDROXY4METHYL3PHENYL8(PYRROLIDIN1YLMETHYL)CHROMEN2ONE
7HYDROXY4METHYL3PHENYL8(PYRROLIDINYLMETHYL)CHROMEN2ONE
CC1=C(C(=O)OC2=C1C=CC(=C2CN3CCCC3)O)C4=CC=CC=C4
InChI=1SC21H21NO3c1141691018(23)17(132211561222)20(16)2521(24)19(14)157324815h2471023H561113H21H3
MFCD06745727
ZINC000004353871
ZINC4353871
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