Vitas-M small molecule compound

1-{[1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-1-oxopropan-2-yl]oxy}-3-methyl-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-one

Catalog ID
STL461111
SMILES Cc1cc(OC(C(=O)N2CCC3(C(C2)CCCC3)O)C)c2c(c1)oc(=O)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 C26H33NO5 MW 439.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33NO5/c1-16-13-21(23-19-8-3-4-9-20(19)25(29)32-22(23)14-16)31-17(2)24(28)27-12-11-26(30)10-6-5-7-18(26)15-27/h13-14,17-18,30H,3-12,15H2,1-2H3
InChIKey
UWTGYNAKLDLHOU-UHFFFAOYSA-N
Synonyms

1((1(4ahydroxyoctahydroisoquinolin2(1H)yl)1oxopropan2yl)oxy)3methyl78910tetrahydro6Hbenzo(c)chromen6one
1(1(4ahydroxy13456788aoctahydroisoquinolin2yl)1oxopropan2yl)oxy3methyl78910tetrahydrobenzo(c)chromen6one
CC1=CC2=C(C3=C(CCCC3)C(=O)O2)C(=C1)OC(C)C(=O)N4CCC5(CCCCC5C4)O
InChI=1SC26H33NO5c1161321(2319834920(19)25(29)3222(23)1416)3117(2)24(28)27121126(30)1065718(26)1527h1314171830H31215H212H3
MFCD10040776
ZINC000002111328
ZINC000238937276

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Available files

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