Vitas-M small molecule compound

3-hydroxy-6-methyl-2-[1-{4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-3-oxo-3-(1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)propyl]-4H-pyran-4-one

Catalog ID
STL544173
SMILES CC(=C)COc1ccc(cc1)C(c1oc(C)cc(=O)c1O)CC(=O)N1CCc2c(C1)[nH]c1c2cccc1

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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 C30H30N2O5 MW 498.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N2O5/c1-18(2)17-36-21-10-8-20(9-11-21)24(30-29(35)27(33)14-19(3)37-30)15-28(34)32-13-12-23-22-6-4-5-7-25(22)31-26(23)16-32/h4-11,14,24,31,35H,1,12-13,15-17H2,2-3H3
InChIKey
RCVMSSWYJVTEKB-UHFFFAOYSA-N
Synonyms
1630847-60-7
1630847607
2(3(34DIHYDRO1HPYRIDO(34B)INDOL2(9H)YL)1(4((2METHYLALLYL)OXY)PHENYL)3OXOPROPYL)3HYDROXY6METHYL4HPYRAN4ONE
3hydroxy6methyl2(1(4((2methylprop2en1yl)oxy)phenyl)3oxo3(1349tetrahydro2Hbetacarbolin2yl)propyl)4Hpyran4one
3hydroxy6methyl2(1(4(2methylprop2enoxy)phenyl)3oxo3(1349tetrahydropyrido(34b)indol2yl)propyl)pyran4one
91637396
CC(=C)COc1ccc(cc1)C(c1oc(C)cc(=O)c1O)CC(=O)N1CCc2c(C1)(nH)c1c2cccc1
InChI=1SC30H30N2O5c118(2)17362110820(91121)24(3029(35)27(33)1419(3)3730)1528(34)3213122322645725(22)3126(23)1632h41114243135H112131517H223H3
MFCD28349334
ZINC000217740400
ZINC000217740475

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Available files

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