Vitas-M small molecule compound
7-hydroxy-3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4,8-dimethyl-2H-chromen-2-one
Catalog ID
STL548450
SMILES O=C(N1CCC2(C(C1)CCCC2)O)CCc1c(=O)oc2c(c1C)ccc(c2C)O
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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 C23H29NO5 MW 399.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO5/c1-14-17-6-8-19(25)15(2)21(17)29-22(27)18(14)7-9-20(26)24-12-11-23(28)10-4-3-5-16(23)13-24/h6,8,16,25,28H,3-5,7,9-13H2,1-2H3InChIKey
BPXMFZBVPOADGH-UHFFFAOYSA-NSynonyms
3(3(4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)3oxopropyl)7hydroxy48dimethylchromen2one
6037364
7hydroxy3(3(4ahydroxyoctahydroisoquinolin2(1H)yl)3oxopropyl)48dimethyl2Hchromen2one
InChI=1SC23H29NO5c114176819(25)15(2)21(17)2922(27)18(14)7920(26)24121123(28)1043516(23)1324h68162528H357913H212H3
MFCD31756760
ZINC000002112188
ZINC000016032588
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