Hautriwaic acid

Datasheet MSDS
Catalog Number
ANC01353
Product Name
Hautriwaic acid
Structure
Hautriwaic acid
CAS Number
18411-75-1
IUPAC Name
(4aR,5S,6R,8aS)-5-[2-(furan-3-yl)ethyl]-8a-(hydroxymethyl)-5,6-dimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid
Synonyms
(4aR)-5β-[2-(3-Furyl)ethyl]-5,6α-dimethyl-8aα-(hydroxymethyl)-3,4,4aβ,5,6,7,8,8a-octahydronaphthalene-1-carboxylicacid
Molecular Formula
C20H28O4
Molecular Weight
332.44
Appearance
Powder
Purity
>97%
SMILES
C[C@@H]1CC[C@@]2([C@@H]([C@@]1(C)CCC3=COC=C3)CCC=C2C(=O)O)CO
InChI
InChI=1S/C20H28O4/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/h4,8,11-12,14,17,21H,3,5-7,9-10,13H2,1-2H3,(H,22,23)/t14-,17-,19+,20-/m1/s1
InChI Key
PHKSUFCCGLWIMC-SIKIZQCASA-N
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