Vitas-M small molecule compound

N-[3-(5-methoxy-1H-indol-1-yl)propanoyl]valine

Catalog ID
STL466664
SMILES COc1ccc2c(c1)ccn2CCC(=O)NC(C(=O)O)C(C)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 C17H22N2O4 MW 318.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O4/c1-11(2)16(17(21)22)18-15(20)7-9-19-8-6-12-10-13(23-3)4-5-14(12)19/h4-6,8,10-11,16H,7,9H2,1-3H3,(H,18,20)(H,21,22)
InChIKey
QRJQBHYYOVKKQD-UHFFFAOYSA-N
Synonyms

(S)2(3(5methoxy1Hindol1yl)propanamido)3methylbutanoicacid
2(3(5methoxyindol1yl)propanoylamino)3methylbutanoicacid
CC(C)C(C(=O)O)NC(=O)CCN1C=CC2=C1C=CC(=C2)OC
COc1ccc2c(c1)ccn2CCC(=O)N(C@H)(C(=O)O)C(C)C
InChI=1SC17H22N2O4c111(2)16(17(21)22)1815(20)791986121013(233)4514(12)19h468101116H79H213H3(H1820)(H2122)
MFCD31750914
N(3(5methoxy1Hindol1yl)propanoyl)valine
ZINC000020761120
ZINC000207892614

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Available files

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