Pterisolic Acid B

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Catalog Number ACM1401419860
CAS 1401419-86-0
IUPAC Name (1S,3S,4S,5R,9R,13R)-3-hydroxy-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.01,10.04,9]hexadec-10-ene-5-carboxylic acid
Molecular Weight 330.4
Molecular Formula C20H26O4
Canonical SMILES CC12CCCC(C1C(CC34C2=CCC(C3)C(=C)C4=O)O)(C)C(=O)O
Inchi InChI=1S/C20H26O4/c1-11-12-5-6-14-18(2)7-4-8-19(3,17(23)24)15(18)13(21)10-20(14,9-12)16(11)22/h6,12-13,15,21H,1,4-5,7-10H2,2-3H3,(H,23,24)/t12-,13+,15+,18+,19-,20+/m1/s1
InChIKey CSODFCSZYDJPLH-SEPLDZIRSA-N
Purity 98%
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