Vitas-M small molecule compound
5-[2-hydroxy-4-(4-hydroxy-3-methoxyphenyl)butyl]-4-methoxy-6,6-dimethyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-6-ium
Catalog ID
STL553328
SMILES COc1c2OCOc2cc2c1C(CC(CCc1ccc(c(c1)OC)O)O)[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 C24H32NO6 MW 430.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31NO6/c1-25(2)10-9-16-12-21-23(31-14-30-21)24(29-4)22(16)18(25)13-17(26)7-5-15-6-8-19(27)20(11-15)28-3/h6,8,11-12,17-18,26H,5,7,9-10,13-14H2,1-4H3/p+1InChIKey
YDIOODKHMXDQNW-UHFFFAOYSA-OSynonyms
3704615
4(3hydroxy4(4methoxy66dimethyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin6ium5yl)butyl)2methoxyphenol
4(3HYDROXY4(4METHOXY66DIMETHYL78DIHYDRO5H(13)DIOXOLO(45G)ISOQUINOLIN6IUM5YL)BUTYL)2METHOXYPHENOL
5(2hydroxy4(4hydroxy3methoxyphenyl)butyl)4methoxy66dimethyl5678tetrahydro(13)dioxolo(45g)isoquinolin6ium
5(2hydroxy4(4hydroxy3methoxyphenyl)butyl)4methoxy66dimethyl5678tetrahydro(13)dioxolo(45g)isoquinolin6iumbromide
COc1c2OCOc2cc2c1C(CC(CCc1ccc(c(c1)OC)O)O)(N+)(CC2)(C)C(Br)
InChI=1SC24H31NO6c125(2)10916122123(31143021)24(294)22(16)18(25)1317(26)75156819(27)20(1115)283h681112171826H579101314H214H3p+1
ZINC000002107240
ZINC000002107246
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