Vitas-M small molecule compound

1-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]proline

Catalog ID
STL565708
SMILES COc1cc(/C=C/C(=O)N2CCCC2C(=O)O)ccc1O

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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 C15H17NO5 MW 291.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17NO5/c1-21-13-9-10(4-6-12(13)17)5-7-14(18)16-8-2-3-11(16)15(19)20/h4-7,9,11,17H,2-3,8H2,1H3,(H,19,20)/b7-5+
InChIKey
SETZGALTVSOSTO-FNORWQNLSA-N
Synonyms

(SE)1(3(4hydroxy3methoxyphenyl)acryloyl)pyrrolidine2carboxylicacid
1((2E)3(4hydroxy3methoxyphenyl)prop2enoyl)proline
1((E)3(4hydroxy3methoxyphenyl)prop2enoyl)pyrrolidine2carboxylicacid
44667212
COc1cc(C=CC(=O)N2CCC(C@H)2C(=O)O)ccc1O
InChI=1SC15H17NO5c12113910(4612(13)17)5714(18)1682311(16)15(19)20h4791117H238H21H3(H1920)b75+
MFCD07637786
ZINC000004090881
ZINC000008995478

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.