Vitas-M small molecule compound
3-(4,8-dimethyl-2-oxo-7-{[(2E)-3-phenylprop-2-en-1-yl]oxy}-2H-chromen-3-yl)propanoic acid
Catalog ID
STL463392
SMILES OC(=O)CCc1c(=O)oc2c(c1C)ccc(c2C)OC/C=C/c1ccccc1
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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 C23H22O5 MW 378.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22O5/c1-15-18-10-12-20(27-14-6-9-17-7-4-3-5-8-17)16(2)22(18)28-23(26)19(15)11-13-21(24)25/h3-10,12H,11,13-14H2,1-2H3,(H,24,25)/b9-6+InChIKey
RJJLNVQCXWLTET-RMKNXTFCSA-NSynonyms
858754-39-9(E)3(7(cinnamyloxy)48dimethyl2oxo2Hchromen3yl)propanoicacid
3(48dimethyl2oxo7(((2E)3phenylprop2en1yl)oxy)2Hchromen3yl)propanoicacid
3(48DIMETHYL2OXO7((E)3PHENYLPROP2ENOXY)CHROMEN3YL)PROPANOICACID
858754399
CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC=CC3=CC=CC=C3)CCC(=O)O
InChI=1SC23H22O5c11518101220(271469177435817)16(2)22(18)2823(26)19(15)111321(24)25h31012H111314H212H3(H2425)b96+
MFCD03853004
OC(=O)CCc1c(=O)oc2c(c1C)ccc(c2C)OCC=Cc1ccccc1
ZINC000002094175
ZINC2094175
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