Vitas-M small molecule compound
4-[(dimethylammonio)methyl]-6-oxo-6,7,8,9,10,11-hexahydrocyclohepta[c]chromen-3-olate
Catalog ID
STL038813
SMILES C[NH+](Cc1c([O-])ccc2c1oc(=O)c1c2CCCCC1)C
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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/c1-18(2)10-14-15(19)9-8-12-11-6-4-3-5-7-13(11)17(20)21-16(12)14/h8-9,19H,3-7,10H2,1-2H3InChIKey
IHXVIQPMKGRQAY-UHFFFAOYSA-NSynonyms
843624-10-24((dimethylammonio)methyl)6oxo67891011hexahydrocyclohepta(c)chromen3olate
4((dimethylazaniumyl)methyl)6oxo891011tetrahydro7Hcyclohepta(c)chromen3olate
843624102
C(NH+)(C)CC1=C(C=CC2=C1OC(=O)C3=C2CCCCC3)(O)
C(NH+)(Cc1c((O))ccc2c1oc(=O)c1c2CCCCC1)C
InChI=1SC17H21NO3c118(2)101415(19)9812116435713(11)17(20)2116(12)14h8919H3710H212H3
MFCD04015566
ZINC000005046816
ZINC5046816
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