2-Picenecarboxylic Acid

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Catalog Number ACM118172808
Product Name 2-Picenecarboxylic Acid
CAS Number 118172-80-8
IUPAC Name 10,11-Dihydroxy-2,4a,6a,6a,14a-pentamethyl-8-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid
Molecular Weight 452.58
Molecular Formula C28H36O5
Canonical SMILES CC12CCC(CC1C3(CCC4(C5=CC(=C(C=C5C(=O)C=C4C3(CC2)C)O)O)C)C)(C)C(=O)O
Inchi InChI=1S/C28H36O5/c1-24-6-7-25(2,23(32)33)15-22(24)28(5)11-9-26(3)17-13-20(31)19(30)12-16(17)18(29)14-21(26)27(28,4)10-8-24/h12-14,22,30-31H,6-11,15H2,1-5H3,(H,32,33)
InChIKey MEUCDRGPRSOAHE-UHFFFAOYSA-N
Purity 98%
Appearance Solid

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