Vitas-M small molecule compound
4-ethyl-5-{[1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-1-oxopropan-2-yl]oxy}-7-methyl-2H-chromen-2-one
Catalog ID
STL461088
SMILES CCc1cc(=O)oc2c1c(cc(c2)C)OC(C(=O)N1CCC2(C(C1)CCCC2)O)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 C24H31NO5 MW 413.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31NO5/c1-4-17-13-21(26)30-20-12-15(2)11-19(22(17)20)29-16(3)23(27)25-10-9-24(28)8-6-5-7-18(24)14-25/h11-13,16,18,28H,4-10,14H2,1-3H3InChIKey
VCBYYOYUJKKMIP-UHFFFAOYSA-NSynonyms
4ETHYL5(((2R)1((4AR8AR)4AHYDROXYOCTAHYDROISOQUINOLIN2(1H)YL)1OXOPROPAN2YL)OXY)7METHYL2HCHROMEN2ONE
4ETHYL5(((2S)1((4AR8AR)4AHYDROXYOCTAHYDROISOQUINOLIN2(1H)YL)1OXOPROPAN2YL)OXY)7METHYL2HCHROMEN2ONE
4ethyl5((1(4ahydroxyoctahydroisoquinolin2(1H)yl)1oxopropan2yl)oxy)7methyl2Hchromen2one
5(1(4ahydroxy13456788aoctahydroisoquinolin2yl)1oxopropan2yl)oxy4ethyl7methylchromen2one
CCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(C)C(=O)N3CCC4(CCCCC4C3)O
InChI=1SC24H31NO5c14171321(26)30201215(2)1119(22(17)20)2916(3)23(27)2510924(28)865718(24)1425h1113161828H41014H213H3
MFCD10040752
ZINC000002112268
ZINC000238937401
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