Vitas-M small molecule compound
5-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-7-methyl-4-propyl-2H-chromen-2-one
Catalog ID
STL461092
SMILES CCCc1cc(=O)oc2c1c(OCC(=O)N1CCC3(C(C1)CCCC3)O)cc(c2)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/c1-3-6-17-13-22(27)30-20-12-16(2)11-19(23(17)20)29-15-21(26)25-10-9-24(28)8-5-4-7-18(24)14-25/h11-13,18,28H,3-10,14-15H2,1-2H3InChIKey
XXBFIILGHOSOBM-UHFFFAOYSA-NSynonyms
5(2((4AR8AR)4AHYDROXYOCTAHYDROISOQUINOLIN2(1H)YL)2OXOETHOXY)7METHYL4PROPYL2HCHROMEN2ONE
5(2(4ahydroxy13456788aoctahydroisoquinolin2yl)2oxoethoxy)7methyl4propylchromen2one
5(2(4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethoxy)7methyl4propyl2Hchromen2one
CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OCC(=O)N3CCC4(CCCCC4C3)O
InChI=1SC24H31NO5c136171322(27)30201216(2)1119(23(17)20)291521(26)2510924(28)854718(24)1425h11131828H3101415H212H3
MFCD10040757
ZINC000002108456
ZINC000011866912
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