Vitas-M small molecule compound
(1S,5R)-3-[3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL551185
SMILES O=C(N1C[C@H]2C[C@@H](C1)C1N(C2)C(=O)CCC1)CCc1c(=O)oc2c(c1C)ccc(c2C)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 C25H30N2O5 MW 438.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O5/c1-14-18-6-8-21(28)15(2)24(18)32-25(31)19(14)7-9-22(29)26-11-16-10-17(13-26)20-4-3-5-23(30)27(20)12-16/h6,8,16-17,20,28H,3-5,7,9-13H2,1-2H3/t16-,17+,20?/m1/s1InChIKey
CXFUZNOBMAUAAY-LIHHCBPRSA-NSynonyms
(1~(S)9~(R))11(3(7hydroxy48dimethyl2oxochromen3yl)propanoyl)711diazatricyclo(7310^(27))tridecan6one
(1R5S)3(3(7hydroxy48dimethyl2oxo2Hchromen3yl)propanoyl)octahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5R)3(3(7hydroxy48dimethyl2oxo2Hchromen3yl)propanoyl)decahydro8H15methanopyrido(12a)(15)diazocin8one
135639940
InChI=1SC25H30N2O5c114186821(28)15(2)24(18)3225(31)19(14)7922(29)2611161017(1326)2043523(30)27(20)1216h6816172028H357913H212H3t1617+20?m1s1
O=C(N1C(C@H)2C(C@H)(C1)(C@H)1N(C2)C(=O)CCC1)CCc1c(=O)oc2c(c1C)ccc(c2C)O
ZINC000583652774
ZINC000583652775
Check stock
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Check stock on Vitas-MAvailable files
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