Vitas-M small molecule compound
(E)-(4-methylphenyl){1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-[4-(propan-2-yloxy)phenyl]pyrrolidin-3-ylidene}methanolate
Catalog ID
STL037904
SMILES CC(Oc1ccc(cc1)C1/C(=C(/c2ccc(cc2)C)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1)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 C28H34N2O5 MW 478.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N2O5/c1-19(2)35-23-11-9-21(10-12-23)25-24(26(31)22-7-5-20(3)6-8-22)27(32)28(33)30(25)14-4-13-29-15-17-34-18-16-29/h5-12,19,25,31H,4,13-18H2,1-3H3/b26-24+InChIKey
OHKVRBNKTQLIAG-SHHOIMCASA-NSynonyms
(4E)4(HYDROXY(4METHYLPHENYL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)5(4PROPAN2YLOXYPHENYL)PYRROLIDINE23DIONE
(E)(4methylphenyl)(1(3(morpholin4ium4yl)propyl)45dioxo2(4(propan2yloxy)phenyl)pyrrolidin3ylidene)methanolate
(E)(4METHYLPHENYL)(1(3MORPHOLIN4IUM4YLPROPYL)45DIOXO2(4PROPAN2YLOXYPHENYL)PYRROLIDIN3YLIDENE)METHANOLATE
3HYDROXY5(4(METHYLETHOXY)PHENYL)4((4METHYLPHENYL)CARBONYL)1(3MORPHOLIN4YLPROPYL)3PYRROLIN2ONE
CC(Oc1ccc(cc1)C1C(=C(c2ccc(cc2)C)(O))C(=O)C(=O)N1CCC(NH+)1CCOCC1)C
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCC(NH+)3CCOCC3)C4=CC=C(C=C4)OC(C)C)(O)
InChI=1SC28H34N2O5c119(2)352311921(101223)2524(26(31)227520(3)6822)27(32)28(33)30(25)1441329151734181629h512192531H41318H213H3b2624+
MFCD18247518
ZINC000102374122
ZINC000102374127
Check stock
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Check stock on Vitas-MAvailable files
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