Vitas-M small molecule compound

N-[(3,4-dimethoxyphenyl)carbonyl]-beta-alanylmethionine

Catalog ID
STL218882
SMILES CSCCC(C(=O)O)NC(=O)CCNC(=O)c1ccc(c(c1)OC)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 C17H24N2O6S MW 384.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H24N2O6S/c1-24-13-5-4-11(10-14(13)25-2)16(21)18-8-6-15(20)19-12(17(22)23)7-9-26-3/h4-5,10,12H,6-9H2,1-3H3,(H,18,21)(H,19,20)(H,22,23)
InChIKey
QSWAPTUFPSPMQX-UHFFFAOYSA-N
Synonyms

2(3((34dimethoxybenzoyl)amino)propanoylamino)4methylsulfanylbutanoicacid
COC1=C(C=C(C=C1)C(=O)NCCC(=O)NC(CCSC)C(=O)O)OC
InChI=1SC17H24N2O6Sc124135411(1014(13)252)16(21)188615(20)1912(17(22)23)79263h451012H69H213H3(H1821)(H1920)(H2223)
MFCD18081906
N((34dimethoxyphenyl)carbonyl)betaalanylmethionine
ZINC000041157883
ZINC000041157886

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Available files

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