Vitas-M small molecule compound
(1S,5R)-3-[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL549733
SMILES O=C(N1C[C@H]2C[C@@H](C1)C1N(C2)C(=O)CCC1)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)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 C29H34N2O5 MW 490.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O5/c1-15-18(4)35-27-17(3)28-23(11-22(15)27)16(2)21(29(34)36-28)8-9-25(32)30-12-19-10-20(14-30)24-6-5-7-26(33)31(24)13-19/h11,19-20,24H,5-10,12-14H2,1-4H3/t19-,20+,24?/m1/s1InChIKey
FGOHFCNXRAAQMW-HVUWCZLESA-NSynonyms
(1~(S)9~(R))11(3(2359tetramethyl7oxofuro(32g)chromen6yl)propanoyl)711diazatricyclo(7310^(27))tridecan6one
(1R5S)3(3(2359tetramethyl7oxo7Hfuro(32g)chromen6yl)propanoyl)octahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5R)3(3(2359tetramethyl7oxo7Hfuro(32g)chromen6yl)propanoyl)decahydro8H15methanopyrido(12a)(15)diazocin8one
135639839
InChI=1SC29H34N2O5c11518(4)352717(3)2823(1122(15)27)16(2)21(29(34)3628)8925(32)3012191020(1430)2465726(33)31(24)1319h11192024H5101214H214H3t1920+24?m1s1
ZINC000524731624
ZINC000524731625
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