Vitas-M small molecule compound
(E)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-[3-(pentyloxy)phenyl]pyrrolidin-3-ylidene}methanolate
Catalog ID
STL037321
SMILES CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1
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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 C31H38N2O6 MW 534.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H38N2O6/c1-3-4-5-15-38-25-8-6-7-22(20-25)28-27(29(34)23-9-10-26-24(19-23)18-21(2)39-26)30(35)31(36)33(28)12-11-32-13-16-37-17-14-32/h6-10,19-21,28,34H,3-5,11-18H2,1-2H3/b29-27+InChIKey
UGBKMWJRHHCRHS-ORIPQNMZSA-NSynonyms
844663-05-4(4E)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)5(3PENTOXYPHENYL)PYRROLIDINE23DIONE
(E)(2methyl23dihydro1benzofuran5yl)(1(2(morpholin4ium4yl)ethyl)45dioxo2(3(pentyloxy)phenyl)pyrrolidin3ylidene)methanolate
(E)(2METHYL23DIHYDRO1BENZOFURAN5YL)(1(2MORPHOLIN4IUM4YLETHYL)45DIOXO2(3PENTOXYPHENYL)PYRROLIDIN3YLIDENE)METHANOLATE
844663054
CCCCCOC1=CC=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OC(C4)C)(O))C(=O)C(=O)N2CC(NH+)5CCOCC5
CCCCCOc1cccc(c1)C1C(=C(c2ccc3c(c2)CC(O3)C)(O))C(=O)C(=O)N1CC(NH+)1CCOCC1
InChI=1SC31H38N2O6c134515382586722(2025)2827(29(34)239102624(1923)1821(2)3926)30(35)31(36)33(28)121132131637171432h61019212834H351118H212H3b2927+
MFCD18247401
ZINC000009312583
ZINC000009313154
Check stock
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