Vitas-M small molecule compound
6-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-2,5-dimethyl-3-phenyl-7H-furo[3,2-g]chromen-7-one
Catalog ID
STL538128
SMILES O=C(N1CCC2(C(C1)CCCC2)O)CCc1c(=O)oc2c(c1C)cc1c(c2)oc(c1c1ccccc1)C
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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 C31H33NO5 MW 499.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33NO5/c1-19-23(11-12-28(33)32-15-14-31(35)13-7-6-10-22(31)18-32)30(34)37-26-17-27-25(16-24(19)26)29(20(2)36-27)21-8-4-3-5-9-21/h3-5,8-9,16-17,22,35H,6-7,10-15,18H2,1-2H3InChIKey
KIBAFRAWLLRTNG-UHFFFAOYSA-NSynonyms
5093628
6(3(4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)3oxopropyl)25dimethyl3phenylfuro(32g)chromen7one
6(3(4ahydroxyoctahydroisoquinolin2(1H)yl)3oxopropyl)25dimethyl3phenyl7Hfuro(32g)chromen7one
InChI=1SC31H33NO5c11923(111228(33)32151431(35)13761022(31)1832)30(34)3726172725(1624(19)26)29(20(2)3627)218435921h358916172235H67101518H212H3
MFCD31754523
ZINC000002110730
ZINC000015954584
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