Vitas-M small molecule compound
3-(carboxymethyl)-5-(3-methoxyphenyl)heptanedioic acid
Catalog ID
STK376693
SMILES COc1cccc(c1)C(CC(=O)O)CC(CC(=O)O)CC(=O)O
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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 C16H20O7 MW 324.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20O7/c1-23-13-4-2-3-11(8-13)12(9-16(21)22)5-10(6-14(17)18)7-15(19)20/h2-4,8,10,12H,5-7,9H2,1H3,(H,17,18)(H,19,20)(H,21,22)InChIKey
DNURMAVVMAOKCH-UHFFFAOYSA-NSynonyms
3(carboxymethyl)5(3methoxyphenyl)heptanedioicacid
5(CARBOXYMETHYL)3(3METHOXYPHENYL)HEPTANEDIOICACID
COC1=CC=CC(=C1)C(CC(CC(=O)O)CC(=O)O)CC(=O)O
InChI=1SC16H20O7c1231342311(813)12(916(21)22)510(614(17)18)715(19)20h2481012H579H21H3(H1718)(H1920)(H2122)
MFCD01192176
ZINC000004178620
ZINC000004178623
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