3,4',5'-Trihydroxy-5-methoxy-2'-methyl-2-biphenylcarboxylic acid

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Systematic / IUPAC Name: 2-(4,5-Dihydroxy-2-methylphenyl)-6-hydroxy-4-methoxybenzoic acid

ID: Reference7638

Other Names: Alutenusin;
[1,1'-Biphenyl]-2-carboxylic acid, 3,4',5'-trihydroxy-5-methoxy-2'-methyl-;
2-(4,5-Dihydroxy-2-methyl-phenyl)-6-hydroxy-4-methoxy-benzoic acid;
3,4',5'-Trihydroxy-5-methoxy-2'-methyl-[1,1'-biphenyl]-2-carboxylic acid

Formula: C15H14O6

Spectral Data

3,4',5'-Trihydroxy-5-methoxy-2'-methyl-2-biphenylcarboxylic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 162
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 3/26/2018 1:33:43 PM
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Identificators

InChI InChI=1S/C15H14O6/c1-7-3-11(16)12(17)6-9(7)10-4-8(21-2)5-13(18)14(10)15(19)20/h3-6,16-18H,1-2H3,(H,19,20)
InChI Key ADPBTBPPIIKLEH-UHFFFAOYSA-N
Canonical SMILES CC1=CC(=C(C=C1C2=CC(=CC(=C2C(=O)O)O)OC)O)O
CAS 31186126
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Other Names Alutenusin;
[1,1'-Biphenyl]-2-carboxylic acid, 3,4',5'-trihydroxy-5-methoxy-2'-methyl-;
2-(4,5-Dihydroxy-2-methyl-phenyl)-6-hydroxy-4-methoxy-benzoic acid;
3,4',5'-Trihydroxy-5-methoxy-2'-methyl-[1,1'-biphenyl]-2-carboxylic acid

In Other Databases

ChemSpider 5293666
PubChem 6918469
ChEMBL CHEMBL483531