Vitas-M small molecule compound
3-ethyl-4-methyl-2-oxo-8-(pyrrolidinium-1-ylmethyl)-2H-chromen-7-olate
Catalog ID
STL044746
SMILES CCc1c(=O)oc2c(c1C)ccc(c2C[NH+]1CCCC1)[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 C17H21NO3 MW 287.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21NO3/c1-3-12-11(2)13-6-7-15(19)14(16(13)21-17(12)20)10-18-8-4-5-9-18/h6-7,19H,3-5,8-10H2,1-2H3InChIKey
SJIHRZWWCIAYNG-UHFFFAOYSA-NSynonyms
842963-53-53ETHYL4METHYL2OXO8(PYRROLIDIN1IUM1YLMETHYL)CHROMEN7OLATE
3ethyl4methyl2oxo8(pyrrolidinium1ylmethyl)2Hchromen7olate
3ETHYL7HYDROXY4METHYL8(PYRROLIDIN1YLMETHYL)CHROMEN2ONE
842963535
CCC1=C(C2=C(C(=C(C=C2)O)CN3CCCC3)OC1=O)C
CCc1c(=O)oc2c(c1C)ccc(c2C(NH+)1CCCC1)(O)
InChI=1SC17H21NO3c131211(2)136715(19)14(16(13)2117(12)20)1018845918h6719H35810H212H3
MFCD04012425
ZINC000005025536
ZINC5025536
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