Vitas-M small molecule compound
7-[(2,6-dichlorobenzyl)oxy]-3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4,8-dimethyl-2H-chromen-2-one
Catalog ID
STL537285
SMILES O=C(N1CCC2(C(C1)CCCC2)O)CCc1c(=O)oc2c(c1C)ccc(c2C)OCc1c(Cl)cccc1Cl
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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 C30H33Cl2NO5 MW 558.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33Cl2NO5/c1-18-21-9-11-26(37-17-23-24(31)7-5-8-25(23)32)19(2)28(21)38-29(35)22(18)10-12-27(34)33-15-14-30(36)13-4-3-6-20(30)16-33/h5,7-9,11,20,36H,3-4,6,10,12-17H2,1-2H3InChIKey
QBNSHQOSLMCATO-UHFFFAOYSA-NSynonyms
3(3(4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)3oxopropyl)7((26dichlorophenyl)methoxy)48dimethylchromen2one
5220122
7((26dichlorobenzyl)oxy)3(3(4ahydroxyoctahydroisoquinolin2(1H)yl)3oxopropyl)48dimethyl2Hchromen2one
InChI=1SC30H33Cl2NO5c1182191126(37172324(31)75825(23)32)19(2)28(21)3829(35)22(18)101227(34)33151430(36)1343620(30)1633h579112036H346101217H212H3
MFCD07204179
ZINC000002109654
ZINC000103529486
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