Vitas-M small molecule compound
7-methyl-2-oxo-4-propyl-6-(pyrrolidinium-1-ylmethyl)-2H-chromen-5-olate
Catalog ID
STK564229
SMILES CCCc1cc(=O)oc2c1c([O-])c(c(c2)C)C[NH+]1CCCC1
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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 C18H23NO3 MW 301.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23NO3/c1-3-6-13-10-16(20)22-15-9-12(2)14(18(21)17(13)15)11-19-7-4-5-8-19/h9-10,21H,3-8,11H2,1-2H3InChIKey
GTTHEKSDBORJDR-UHFFFAOYSA-NSynonyms
701929-75-15HYDROXY7METHYL4PROPYL6(1PYRROLIDINYLMETHYL)1BENZOPYRAN2ONE
5HYDROXY7METHYL4PROPYL6(1PYRROLIDINYLMETHYL)2HCHROMEN2ONE
5HYDROXY7METHYL4PROPYL6(PYRROLIDIN1YLMETHYL)CHROMEN2ONE
5HYDROXY7METHYL4PROPYL6(PYRROLIDINOMETHYL)COUMARIN
701929751
7METHYL2OXO4PROPYL6(PYRROLIDIN1IUM1YLMETHYL)CHROMEN5OLATE
7methyl2oxo4propyl6(pyrrolidinium1ylmethyl)2Hchromen5olate
7METHYL5OXIDANYL4PROPYL6(PYRROLIDIN1YLMETHYL)CHROMEN2ONE
CCCC1=CC(=O)OC2=C1C(=C(C(=C2)C)C(NH+)3CCCC3)(O)
CCCc1cc(=O)oc2c1c((O))c(c(c2)C)C(NH+)1CCCC1
InChI=1SC18H23NO3c136131016(20)2215912(2)14(18(21)17(13)15)1119745819h91021H3811H212H3
MFCD04016867
ZINC000005047128
ZINC5047128
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