Vitas-M small molecule compound

(E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-[4-(propan-2-yloxy)phenyl]pyrrolidin-3-ylidene}(5-methylfuran-2-yl)methanolate

Catalog ID
STL149199
SMILES CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2ccc(o2)C)/[O-])/C1c1ccc(cc1)OC(C)C)CC

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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 C26H34N2O5 MW 454.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N2O5/c1-6-27(7-2)15-8-16-28-23(19-10-12-20(13-11-19)32-17(3)4)22(25(30)26(28)31)24(29)21-14-9-18(5)33-21/h9-14,17,23,29H,6-8,15-16H2,1-5H3/b24-22+
InChIKey
JSELYGNBHDXFNV-ZNTNEXAZSA-N
Synonyms

CC(NH+)(CCCN1C(=O)C(=O)C(=C(c2ccc(o2)C)(O))C1c1ccc(cc1)OC(C)C)CC
MFCD20755551
ZINC000009271644
ZINC000009271645

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Available files

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