Dehydrohautriwaic Acid

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Catalog Number ACM51905841
CAS 51905-84-1
IUPAC Name (4aR,5S,6R,8aS)-5-[2-(furan-3-yl)ethyl]-8a-(hydroxymethyl)-5,6-dimethyl-4a,6,7,8-tetrahydronaphthalene-1-carboxylic acid
Molecular Weight 330.42
Molecular Formula C20H26O4
Canonical SMILES CC1CCC2(C(C1(C)CCC3=COC=C3)C=CC=C2C(=O)O)CO
Inchi InChI=1S/C20H26O4/c1-14-6-10-20(13-21)16(18(22)23)4-3-5-17(20)19(14,2)9-7-15-8-11-24-12-15/h3-5,8,11-12,14,17,21H,6-7,9-10,13H2,1-2H3,(H,22,23)/t14-,17-,19+,20-/m1/s1
InChIKey XLOARMGSPCGDKT-SIKIZQCASA-N
Purity 98%
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