Metasequoic Acid A

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Catalog Number ACM113626225
Product Name Metasequoic Acid A
CAS Number 113626-22-5
Structure Metasequoic Acid A
IUPAC Name (E)-5-[(1aR,3aR,4S,7aS,7bS)-3a,7b-dimethyl-5-methylidene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl]-3-methylpent-2-enoic acid
Molecular Weight 302.5
Molecular Formula C20H30O2
Canonical SMILES CC(=CC(=O)O)CCC1C(=C)CCC2C1(CCC3C2(C3)C)C
Inchi InChI=1S/C20H30O2/c1-13(11-18(21)22)5-7-16-14(2)6-8-17-19(16,3)10-9-15-12-20(15,17)4/h11,15-17H,2,5-10,12H2,1,3-4H3,(H,21,22)/b13-11+/t15-,16+,17-,19-,20+/m1/s1
InChIKey PCLDEDSUWNZZDJ-BDBJVFIPSA-N
Purity 98%
Appearance Powder

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