Vitas-M small molecule compound
4-({[3-(2-carboxyethyl)-4-methyl-2-oxo-2H-chromen-7-yl]oxy}methyl)benzoic acid
Catalog ID
STL463287
SMILES OC(=O)CCc1c(=O)oc2c(c1C)ccc(c2)OCc1ccc(cc1)C(=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 C21H18O7 MW 382.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18O7/c1-12-16-7-6-15(27-11-13-2-4-14(5-3-13)20(24)25)10-18(16)28-21(26)17(12)8-9-19(22)23/h2-7,10H,8-9,11H2,1H3,(H,22,23)(H,24,25)InChIKey
IYTOIFHTZSYTAF-UHFFFAOYSA-NSynonyms
708243-53-24(((3(2carboxyethyl)4methyl2oxo2Hchromen7yl)oxy)methyl)benzoicacid
4((3(2CARBOXYETHYL)4METHYL2OXOCHROMEN7YL)OXYMETHYL)BENZOICACID
708243532
CC1=C(C(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)C(=O)O)CCC(=O)O
InChI=1SC21H18O7c112167615(2711132414(5313)20(24)25)1018(16)2821(26)17(12)8919(22)23h2710H8911H21H3(H2223)(H2425)
MFCD03852326
ZINC000002092891
ZINC2092891
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