Vitas-M small molecule compound

N-{3-hydroxy-3-[4-(3-methylbutoxy)phenyl]propyl}valine

Catalog ID
STL569055
SMILES CC(CCOc1ccc(cc1)C(CCNC(C(=O)O)C(C)C)O)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 C19H31NO4 MW 337.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H31NO4/c1-13(2)10-12-24-16-7-5-15(6-8-16)17(21)9-11-20-18(14(3)4)19(22)23/h5-8,13-14,17-18,20-21H,9-12H2,1-4H3,(H,22,23)
InChIKey
OUWRGZLPPUMWJB-UHFFFAOYSA-N
Synonyms

2((3hydroxy3(4(3methylbutoxy)phenyl)propyl)amino)3methylbutanoicacid
2((3hydroxy3(4(isopentyloxy)phenyl)propyl)amino)3methylbutanoicacid
45135051
InChI=1SC19H31NO4c113(2)101224167515(6816)17(21)9112018(14(3)4)19(22)23h58131417182021H912H214H3(H2223)
MFCD32654067
N(3hydroxy3(4(3methylbutoxy)phenyl)propyl)valine
ZINC000027517025
ZINC000027517028

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Available files

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