Vitas-M small molecule compound
(6R,6aS)-3-nitro-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]-10-oxo-6,6a,7,8,14,15-hexahydro-5H,10H-7,14-methanopyrido[1',2':5,6][1,5]diazocino[1,2-a]quinoline-6-carboxamide
Catalog ID
STL550751
SMILES O=C([C@@H]1Cc2cc(ccc2N2[C@H]1[C@H]1C[C@@H](C2)c2n(C1)c(=O)ccc2)[N+](=O)[O-])NC[C@@H]1CCCN2[C@@H]1CCCC2
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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 C30H37N5O4 MW 531.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H37N5O4/c36-28-8-3-7-26-21-13-22(18-33(26)28)29-24(15-20-14-23(35(38)39)9-10-27(20)34(29)17-21)30(37)31-16-19-5-4-12-32-11-2-1-6-25(19)32/h3,7-10,14,19,21-22,24-25,29H,1-2,4-6,11-13,15-18H2,(H,31,37)/t19-,21?,22?,24+,25+,29-/m0/s1InChIKey
ZMJITLWEYXUXSG-QZZGKELQSA-NSynonyms
(2~(S)3~(R))~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)7nitro18oxo1119diazapentacyclo(11710^(211)0^(510)0^(1419))henicosa5(10)681416pentaene3carboxamide
(6R6aS)3nitroN(((1S9aR)octahydro1Hquinolizin1yl)methyl)10oxo566a78101415octahydro714methanopyrido(1256)(15)diazocino(12a)quinoline6carboxamide
(6R6aS)3nitroN((1S9aR)octahydro2Hquinolizin1ylmethyl)10oxo66a781415hexahydro5H10H714methanopyrido(1256)(15)diazocino(12a)quinoline6carboxamide
127252954
InChI=1SC30H37N5O4c362883726211322(1833(26)28)2924(15201423(35(38)39)91027(20)34(29)1721)30(37)3116195412321121625(19)32h371014192122242529H124611131518H2(H3137)t1921?22?24+25+29m0s1
O=C((C@@H)1Cc2cc(ccc2N2(C@H)1C1CC(C2)c2n(C1)c(=O)ccc2)(N+)(=O)(O))NC(C@@H)1CCCN2(C@@H)1CCCC2
ZINC001547138151
Check stock
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