Vitas-M small molecule compound

3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4,8-dimethyl-7-(naphthalen-2-ylmethoxy)-2H-chromen-2-one

Catalog ID
STL565890
SMILES O=C(N1CCC2(C(C1)CCCC2)O)CCc1c(=O)oc2c(c1C)ccc(c2C)OCc1ccc2c(c1)cccc2

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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 C34H37NO5 MW 539.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H37NO5/c1-22-28-12-14-30(39-21-24-10-11-25-7-3-4-8-26(25)19-24)23(2)32(28)40-33(37)29(22)13-15-31(36)35-18-17-34(38)16-6-5-9-27(34)20-35/h3-4,7-8,10-12,14,19,27,38H,5-6,9,13,15-18,20-21H2,1-2H3
InChIKey
RXVCPLLHDQGSFG-UHFFFAOYSA-N
Synonyms

3(3(4ahydroxy13456788aoctahydroisoquinolin2yl)3oxopropyl)48dimethyl7(naphthalen2ylmethoxy)chromen2one
3(3(4ahydroxyoctahydroisoquinolin2(1H)yl)3oxopropyl)48dimethyl7(naphthalen2ylmethoxy)2Hchromen2one
4555604
InChI=1SC34H37NO5c12228121430(392124101125734826(25)1924)23(2)32(28)4033(37)29(22)131531(36)35181734(38)1665927(34)2035h3478101214192738H5691315182021H212H3
MFCD32651756
ZINC000002109100
ZINC000109723021

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Available files

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