Vitas-M small molecule compound
7-hydroxy-3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4-methyl-2H-chromen-2-one
Catalog ID
STL461185
SMILES Oc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCC2(C(C1)CCCC2)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 C22H27NO5 MW 385.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO5/c1-14-17-6-5-16(24)12-19(17)28-21(26)18(14)7-8-20(25)23-11-10-22(27)9-3-2-4-15(22)13-23/h5-6,12,15,24,27H,2-4,7-11,13H2,1H3InChIKey
DOXLFTXIBWNBEV-UHFFFAOYSA-NSynonyms
3(3(4ahydroxy13456788aoctahydroisoquinolin2yl)3oxopropyl)7hydroxy4methylchromen2one
7hydroxy3(3(4ahydroxyoctahydroisoquinolin2(1H)yl)3oxopropyl)4methyl2Hchromen2one
CC1=C(C(=O)OC2=C1C=CC(=C2)O)CCC(=O)N3CCC4(CCCCC4C3)O
InChI=1SC22H27NO5c114176516(24)1219(17)2821(26)18(14)7820(25)23111022(27)932415(22)1323h5612152427H2471113H21H3
MFCD10040847
ZINC000002109222
ZINC000011867137
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