Vitas-M small molecule compound
(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-6-hydroxy-7-methyl-1-benzofuran-3(2H)-one
Catalog ID
STL033273
SMILES O=C1/C(=C/c2ccc3c(c2)OCO3)/Oc2c1ccc(c2C)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 C17H12O5 MW 296.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12O5/c1-9-12(18)4-3-11-16(19)15(22-17(9)11)7-10-2-5-13-14(6-10)21-8-20-13/h2-7,18H,8H2,1H3/b15-7-InChIKey
AWXYMGVAGFPRNB-CHHVJCJISA-NSynonyms
859131-56-9(2Z)2(13benzodioxol5ylmethylidene)6hydroxy7methyl1benzofuran3(2H)one
(2Z)2(13BENZODIOXOL5YLMETHYLIDENE)6HYDROXY7METHYL1BENZOFURAN3ONE
(Z)2(benzo(d)(13)dioxol5ylmethylene)6hydroxy7methylbenzofuran3(2H)one
2(2HBENZO(34D)13DIOXOLEN5YLMETHYLENE)6HYDROXY7METHYLBENZO(B)FURAN3ONE
859131569
CC1=C(C=CC2=C1OC(=CC3=CC4=C(C=C3)OCO4)C2=O)O
InChI=1SC17H12O5c1912(18)431116(19)15(2217(9)11)710251314(610)2182013h2718H8H21H3b157
MFCD06492708
O=C1C(=Cc2ccc3c(c2)OCO3)Oc2c1ccc(c2C)O
ZINC000004470585
ZINC04470585
ZINC4470585
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