Vitas-M small molecule compound
4-methoxy-6,6-dimethyl-5-[(2,5,5-trimethyl-3,4,4a,10b-tetrahydro-2H,5H-pyrano[3,2-c]chromen-2-yl)ethynyl]-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-6-ium
Catalog ID
STL553012
SMILES COc1c2OCOc2cc2c1C(C#CC1(C)CCC3C(O1)c1ccccc1OC3(C)C)[N+](CC2)(C)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 C30H36NO5 MW 490.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H36NO5/c1-29(2)21-11-14-30(3,36-26(21)20-9-7-8-10-23(20)35-29)15-12-22-25-19(13-16-31(22,4)5)17-24-27(28(25)32-6)34-18-33-24/h7-10,17,21-22,26H,11,13-14,16,18H2,1-6H3/q+1InChIKey
DVCAFCGULOZKGX-UHFFFAOYSA-NSynonyms
3682838
4methoxy66dimethyl5((255trimethyl2344a510bhexahydropyrano(32c)chromen2yl)ethynyl)5678tetrahydro(13)dioxolo(45g)isoquinolin6iumiodide
4methoxy66dimethyl5((255trimethyl344a10btetrahydro2H5Hpyrano(32c)chromen2yl)ethynyl)5678tetrahydro(13)dioxolo(45g)isoquinolin6ium
4methoxy66dimethyl5(2(255trimethyl344~(a)10~(b)tetrahydropyrano(32c)chromen2yl)ethynyl)78dihydro5~(H)(13)dioxolo(45g)isoquinolin6ium
4METHOXY66DIMETHYL5(2(255TRIMETHYL344A10BTETRAHYDROPYRANO(32C)CHROMEN2YL)ETHYNYL)78DIHYDRO5H(13)DIOXOLO(45G)ISOQUINOLIN6IUM
COc1c2OCOc2cc2c1C(C#CC1(C)CCC3C(O1)c1ccccc1OC3(C)C)(N+)(CC2)(C)C(I)
InChI=1SC30H36NO5c129(2)21111430(33626(21)209781023(20)3529)1512222519(131631(224)5)172427(28(25)326)34183324h71017212226H1113141618H216H3q+1
ZINC000012660660
ZINC000247636537
Check stock
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