Vitas-M small molecule compound
(1S,5R)-3-[3-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL534934
SMILES COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
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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 C25H26N2O5 MW 434.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O5/c1-15-19-7-6-18(31-2)11-22(19)32-25(30)20(15)8-9-23(28)26-12-16-10-17(14-26)21-4-3-5-24(29)27(21)13-16/h3-7,11,16-17H,8-10,12-14H2,1-2H3/t16-,17+/m0/s1InChIKey
YGEOJCOSVJBNDW-DLBZAZTESA-NSynonyms
(1R5S)3(3(7methoxy4methyl2oxo2Hchromen3yl)propanoyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5R)3(3(7methoxy4methyl2oxo2Hchromen3yl)propanoyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC25H26N2O5c115197618(312)1122(19)3225(30)20(15)8923(28)2612161017(1426)2143524(29)27(21)1316h37111617H8101214H212H3t1617+m0s1
MFCD08283183
ZINC000008877043
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