Vitas-M small molecule compound

N-{3-[6-(benzyloxy)-1H-indol-1-yl]propanoyl}alanine

Catalog ID
STL468742
SMILES O=C(NC(C(=O)O)C)CCn1ccc2c1cc(OCc1ccccc1)cc2

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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 C21H22N2O4 MW 366.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O4/c1-15(21(25)26)22-20(24)10-12-23-11-9-17-7-8-18(13-19(17)23)27-14-16-5-3-2-4-6-16/h2-9,11,13,15H,10,12,14H2,1H3,(H,22,24)(H,25,26)
InChIKey
YZGMVTQMTSZFAZ-UHFFFAOYSA-N
Synonyms

(S)2(3(6(benzyloxy)1Hindol1yl)propanamido)propanoicacid
2(3(6phenylmethoxyindol1yl)propanoylamino)propanoicacid
CC(C(=O)O)NC(=O)CCN1C=CC2=C1C=C(C=C2)OCC3=CC=CC=C3
InChI=1SC21H22N2O4c115(21(25)26)2220(24)101223119177818(1319(17)23)2714165324616h29111315H101214H21H3(H2224)(H2526)
MFCD31751047
N(3(6(benzyloxy)1Hindol1yl)propanoyl)alanine
O=C(N(C@H)(C(=O)O)C)CCn1ccc2c1cc(OCc1ccccc1)cc2
ZINC000040310261
ZINC000206413358

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Available files

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