Thielavin A

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Catalog Number ACM71950668
Product Name Thielavin A
CAS Number 71950-66-8
Structure Thielavin A
IUPAC Name 4-[4-(2,4-dihydroxy-3,6-dimethylbenzoyl)oxy-2-hydroxy-3,5,6-trimethylbenzoyl]oxy-2-hydroxy-3,5,6-trimethylbenzoic acid
Synonyms Thielavin-A, Thielavin A, CID194424, 71950-66-8, Benzoic acid, 4-((2,4-dihydroxy-3,6-dimethylbenzoyl)oxy)-2-hydroxy-3,5,6-trimethyl-, 4-carboxy-3-hydroxy-2,5,6-trimethylphenyl ester
Molecular Weight 538.5
Molecular Formula C29H30O10
Canonical SMILES CC1=CC(=C(C(=C1C(=O)OC2=C(C(=C(C(=C2C)O)C(=O)OC3=C(C(=C(C(=C3C)O)C(=O)O)C)C)C)C)O)C)O
InChIKey MGGMNKJGDSNTKZ-UHFFFAOYSA-N
Boiling Point 849.97 °C at 760 mmHg (Predicted)
Flash Point 281ºC
Purity 94%
Density 1.371g/cm³

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