Vitas-M small molecule compound

5-[3-(biphenyl-4-yloxy)prop-1-yn-1-yl]-4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinoline

Catalog ID
STL527894
SMILES COc1c2c(CCN(C2C#CCOc2ccc(cc2)c2ccccc2)C)cc2c1OCO2

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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 C27H25NO4 MW 427.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25NO4/c1-28-15-14-21-17-24-26(32-18-31-24)27(29-2)25(21)23(28)9-6-16-30-22-12-10-20(11-13-22)19-7-4-3-5-8-19/h3-5,7-8,10-13,17,23H,14-16,18H2,1-2H3
InChIKey
YANGYWZWLZPSQB-UHFFFAOYSA-N
Synonyms
858741-41-0
3360293
4methoxy6methyl5(3(4phenylphenoxy)prop1ynyl)78dihydro5~(H)(13)dioxolo(45g)isoquinoline
4METHOXY6METHYL5(3(4PHENYLPHENOXY)PROP1YNYL)78DIHYDRO5H(13)DIOXOLO(45G)ISOQUINOLINE
5(3((11biphenyl)4yloxy)prop1yn1yl)4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinoline
5(3(biphenyl4yloxy)prop1yn1yl)4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinoline
858741410
InChI=1SC27H25NO4c128151421172426(32183124)27(292)25(21)23(28)96163022121020(111322)197435819h357810131723H141618H212H3
MFCD03661402
ZINC000020410540
ZINC000020410544

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Available files

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