Vitas-M small molecule compound
4-methoxy-6-(2-methoxy-2-oxoethyl)-6-methyl-9-{(2E)-3-[4-(prop-2-en-1-yloxy)phenyl]prop-2-enoyl}-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-6-ium
Catalog ID
STL553011
SMILES C=CCOc1ccc(cc1)/C=C/C(=O)c1c2CC[N+](Cc2c(c2c1OCO2)OC)(C)CC(=O)OC
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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 C27H30NO7 MW 480.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30NO7/c1-5-14-33-19-9-6-18(7-10-19)8-11-22(29)24-20-12-13-28(2,16-23(30)31-3)15-21(20)25(32-4)27-26(24)34-17-35-27/h5-11H,1,12-17H2,2-4H3/q+1/b11-8+InChIKey
BXYUDFXLIGOMNF-DHZHZOJOSA-NSynonyms
(E)9(3(4(allyloxy)phenyl)acryloyl)4methoxy6(2methoxy2oxoethyl)6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin6iumbromide
4methoxy6(2methoxy2oxoethyl)6methyl9((2E)3(4(prop2en1yloxy)phenyl)prop2enoyl)5678tetrahydro(13)dioxolo(45g)isoquinolin6ium
5918461
C=CCOc1ccc(cc1)C=CC(=O)c1c2CC(N+)(Cc2c(c2c1OCO2)OC)(C)CC(=O)OC(Br)
InChI=1SC27H30NO7c151433199618(71019)81122(29)2420121328(21623(30)313)1521(20)25(324)2726(24)34173527h511H11217H224H3q+1b118+
methyl2(4methoxy6methyl9((~(E))3(4prop2enoxyphenyl)prop2enoyl)78dihydro5~(H)(13)dioxolo(45g)isoquinolin6ium6yl)acetate
METHYL2(4METHOXY6METHYL9((E)3(4PROP2ENOXYPHENYL)PROP2ENOYL)78DIHYDRO5H(13)DIOXOLO(45G)ISOQUINOLIN6IUM6YL)ACETATE
ZINC000253390374
ZINC000253390376
ZINC9333721
Check stock
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Check stock on Vitas-MAvailable files
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