Vitas-M small molecule compound

N-[(3S)-1,2,3,4-tetrahydroisoquinolin-3-ylcarbonyl]-L-alanine

Catalog ID
STL530419
SMILES OC(=O)[C@@H](NC(=O)[C@H]1NCc2c(C1)cccc2)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 C13H16N2O3 MW 248.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O3/c1-8(13(17)18)15-12(16)11-6-9-4-2-3-5-10(9)7-14-11/h2-5,8,11,14H,6-7H2,1H3,(H,15,16)(H,17,18)/t8-,11-/m0/s1
InChIKey
WEBPJWAIDBPDRF-KWQFWETISA-N
Synonyms

(2~(S))2(((3~(S))1234tetrahydroisoquinoline3carbonyl)amino)propanoicacid
(S)2((S)1234tetrahydroisoquinoline3carboxamido)propanoicacidhydrochloride
7094806
InChI=1SC13H16N2O3c18(13(17)18)1512(16)1169423510(9)71411h2581114H67H21H3(H1516)(H1718)t811m0s1
N((3S)1234tetrahydroisoquinolin3ylcarbonyl)Lalanine
OC(=O)(C@@H)(NC(=O)(C@H)1NCc2c(C1)cccc2)CCl
ZINC000004085240
ZINC4085240

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Available files

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