Vitas-M small molecule compound
(1R,9R,16S,16aR)-4-(acetylamino)-12-oxo-N-[2-(pyridin-2-yl)ethyl]-1,9,10,12,16,16a-hexahydro-2H,8H-9,16-methanopyrido[2',1':4,5][1,5]diazocino[1,2-a]quinoline-1-carboxamide
Catalog ID
STL551685
SMILES CC(=O)Nc1ccc2c(c1)C[C@H]([C@@H]1N2C[C@H]2C[C@@H]1c1n(C2)c(=O)ccc1)C(=O)NCCc1ccccn1
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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 C29H31N5O3 MW 497.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N5O3/c1-18(35)32-22-8-9-25-20(14-22)15-24(29(37)31-12-10-21-5-2-3-11-30-21)28-23-13-19(17-34(25)28)16-33-26(23)6-4-7-27(33)36/h2-9,11,14,19,23-24,28H,10,12-13,15-17H2,1H3,(H,31,37)(H,32,35)/t19-,23+,24+,28+/m0/s1InChIKey
URXBDGOYWNUPAW-PBDIFJQKSA-NSynonyms
(1~(S)2~(R)3~(R)13~(R))7acetamido16oxo~(N)(2pyridin2ylethyl)1115diazapentacyclo(11710^(211)0^(510)0^(1520))henicosa5(10)681719pentaene3carboxamide
(1R9R16S16aR)4(acetylamino)12oxoN(2(pyridin2yl)ethyl)1910121616ahexahydro2H8H916methanopyrido(2145)(15)diazocino(12a)quinoline1carboxamide
(1R9R16S16aR)4acetamido12oxoN(2(pyridin2yl)ethyl)128910121616aoctahydro916methanopyrido(2145)(15)diazocino(12a)quinoline1carboxamide
135640044
CC(=O)Nc1ccc2c(c1)C(C@H)((C@@H)1N2C(C@H)2C(C@@H)1c1n(C2)c(=O)ccc1)C(=O)NCCc1ccccn1
InChI=1SC29H31N5O3c118(35)3222892520(1422)1524(29(37)31121021523113021)28231319(1734(25)28)163326(23)64727(33)36h29111419232428H1012131517H21H3(H3137)(H3235)t1923+24+28+m0s1
ZINC001772492906
Check stock
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Check stock on Vitas-MAvailable files
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