Vitas-M small molecule compound

4-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-6-hydroxy-7-methyl-2H-chromen-2-one

Catalog ID
STK925127
SMILES O=c1cc(CN2CCC3(CC2)OCCO3)c2c(o1)cc(c(c2)O)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 C18H21NO5 MW 331.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO5/c1-12-8-16-14(10-15(12)20)13(9-17(21)24-16)11-19-4-2-18(3-5-19)22-6-7-23-18/h8-10,20H,2-7,11H2,1H3
InChIKey
QSKBMXSBCJZJLC-UHFFFAOYSA-N
Synonyms
859108-21-7
4((14DIOXA8AZASPIRO(45)DEC8YL)METHYL)6HYDROXY7METHYLCHROMEN2ONE
4(14dioxa8azaspiro(45)dec8ylmethyl)6hydroxy7methyl2Hchromen2one
4(14DIOXA8AZASPIRO(45)DECAN8YLMETHYL)6HYDROXY7METHYL2HCHROMEN2ONE
4(14DIOXA8AZASPIRO(45)DECAN8YLMETHYL)6HYDROXY7METHYLCHROMEN2ONE
4(14dioxa8azoniaspiro(45)decan8ylmethyl)7methyl2oxochromen6olate
CC1=C(C=C2C(=CC(=O)OC2=C1)C(NH+)3CCC4(CC3)OCCO4)(O)
InChI=1SC18H21NO5c11281614(1015(12)20)13(917(21)2416)11194218(3519)22672318h81020H2711H21H3
ZINC54105961

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Available files

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