Vitas-M small molecule compound
N-[(3,4,5-trimethoxyphenyl)carbonyl]-beta-alanylphenylalanine
Catalog ID
STL219390
SMILES COc1cc(cc(c1OC)OC)C(=O)NCCC(=O)NC(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 C22H26N2O7 MW 430.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O7/c1-29-17-12-15(13-18(30-2)20(17)31-3)21(26)23-10-9-19(25)24-16(22(27)28)11-14-7-5-4-6-8-14/h4-8,12-13,16H,9-11H2,1-3H3,(H,23,26)(H,24,25)(H,27,28)InChIKey
DBRLCIGSAPFICM-UHFFFAOYSA-NSynonyms
3phenyl2(3((345trimethoxybenzoyl)amino)propanoylamino)propanoicacid
COC1=CC(=CC(=C1OC)OC)C(=O)NCCC(=O)NC(CC2=CC=CC=C2)C(=O)O
InChI=1SC22H26N2O7c129171215(1318(302)20(17)313)21(26)2310919(25)2416(22(27)28)11147546814h48121316H911H213H3(H2326)(H2425)(H2728)
MFCD19380912
N((345trimethoxyphenyl)carbonyl)betaalanylphenylalanine
ZINC000046086241
ZINC000046086243
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