Vitas-M small molecule compound
(1S,5R)-3-{[(3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL550574
SMILES O=C(N1C[C@H]2C[C@@H](C1)C1N(C2)C(=O)CCC1)COc1ccc2c(c1C)oc(=O)c(c2C)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 C25H30N2O5 MW 438.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O5/c1-14-15(2)25(30)32-24-16(3)21(8-7-19(14)24)31-13-23(29)26-10-17-9-18(12-26)20-5-4-6-22(28)27(20)11-17/h7-8,17-18,20H,4-6,9-13H2,1-3H3/t17-,18+,20?/m1/s1InChIKey
HPEYOMHRHYKCSP-ZOVQDZKKSA-NSynonyms
(1~(S)9~(R))11(2(348trimethyl2oxochromen7yl)oxyacetyl)711diazatricyclo(7310^(27))tridecan6one
(1R5S)3(2((348trimethyl2oxo2Hchromen7yl)oxy)acetyl)octahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5R)3(((348trimethyl2oxo2Hchromen7yl)oxy)acetyl)decahydro8H15methanopyrido(12a)(15)diazocin8one
135639909
InChI=1SC25H30N2O5c11415(2)25(30)322416(3)21(8719(14)24)311323(29)261017918(1226)2054622(28)27(20)1117h78171820H46913H213H3t1718+20?m1s1
ZINC000524729181
ZINC000524729182
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