Vitas-M small molecule compound

methyl 3,4,6-trihydroxy-5-oxo-5H-benzo[7]annulene-8-carboxylate

Catalog ID
STK785494
SMILES COC(=O)c1cc(O)c(=O)c2c(c1)ccc(c2O)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 C13H10O6 MW 262.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10O6/c1-19-13(18)7-4-6-2-3-8(14)11(16)10(6)12(17)9(15)5-7/h2-5,14,16H,1H3,(H,15,17)
InChIKey
DQWQITFUWFBXON-UHFFFAOYSA-N
Synonyms

5HBENZO(A)CYCLOHEPTENE8CARBOXYLICACID346TRIHYDROXY5OXOMETHYLESTER
COC(=O)C1=CC(=O)C(=C2C(=C1)C=CC(=C2O)O)O
InChI=1SC13H10O6c11913(18)746238(14)11(16)10(6)12(17)9(15)57h251416H1H3(H1517)
METHYL289TRIHYDROXY1OXOBENZO(C)(7)ANNULENE4CARBOXYLATE
METHYL345TRIHYDROXY6OXOBENZO(7)ANNULENE8CARBOXYLATE
methyl346trihydroxy5oxo5Hbenzo(7)annulene8carboxylate
METHYL7DESHYDROXYPYROGALLIN4CARBOXYLATE
MFCD00597901
ZINC000003198921
ZINC3198921

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.