Vitas-M small molecule compound
6-methoxy-1-{4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl}-2,3,4,9-tetrahydro-1H-beta-carbolin-2-ium
Catalog ID
STL553178
SMILES COc1ccc(cc1COc1ccc(cc1)[N+](=O)[O-])C1[NH2+]CCc2c1[nH]c1c2cc(cc1)OC
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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 C26H26N3O5 MW 460.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O5/c1-32-20-8-9-23-22(14-20)21-11-12-27-25(26(21)28-23)16-3-10-24(33-2)17(13-16)15-34-19-6-4-18(5-7-19)29(30)31/h3-10,13-14,25,27-28H,11-12,15H2,1-2H3/p+1InChIKey
UFZICYSLNXTLDG-UHFFFAOYSA-OSynonyms
3878441
6methoxy1(4methoxy3((4nitrophenoxy)methyl)phenyl)2349tetrahydro1~(H)pyrido(34b)indol2ium
6methoxy1(4methoxy3((4nitrophenoxy)methyl)phenyl)2349tetrahydro1Hbetacarbolin2ium
6methoxy1(4methoxy3((4nitrophenoxy)methyl)phenyl)2349tetrahydro1Hpyrido(34b)indole
COc1ccc(cc1COc1ccc(cc1)(N+)(=O)(O))C1NCCc2c1(nH)c1c2cc(cc1)OC
InChI=1SC26H25N3O5c13220892322(1420)2111122725(26(21)2823)1631024(332)17(1316)1534196418(5719)29(30)31h3101314252728H111215H212H3p+1
ZINC000020111764
ZINC000020111766
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