Vitas-M small molecule compound

N-{2-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]propanoyl}-L-phenylalanine

Catalog ID
STK090028
SMILES O=C(C(Oc1ccc2c(c1)oc(=O)cc2C)C)N[C@H](C(=O)O)Cc1ccccc1

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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 C22H21NO6 MW 395.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO6/c1-13-10-20(24)29-19-12-16(8-9-17(13)19)28-14(2)21(25)23-18(22(26)27)11-15-6-4-3-5-7-15/h3-10,12,14,18H,11H2,1-2H3,(H,23,25)(H,26,27)/t14?,18-/m0/s1
InChIKey
AQQSKAPNJWFLNT-IBYPIGCZSA-N
Synonyms
312962-73-5
(2S)2(2((4methyl2oxo2Hchromen7yl)oxy)propanamido)3phenylpropanoicacid
(2S)2(2(4methyl2oxochromen7yl)oxypropanoylamino)3phenylpropanoicacid
312962735
CC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C(=O)NC(CC3=CC=CC=C3)C(=O)O
InChI=1SC22H21NO6c1131020(24)29191216(8917(13)19)2814(2)21(25)2318(22(26)27)11156435715h310121418H11H212H3(H2325)(H2627)t14?18m0s1
MFCD01543902
N(2((4METHYL2OXO2HCHROMEN7YL)OXY)PROPANOYL)LPHENYLALANINE
O=C(C(Oc1ccc2c(c1)oc(=O)cc2C)C)N(C@H)(C(=O)O)Cc1ccccc1
STK090028
ZINC000000945242
ZINC000003195994

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Available files

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