Isopimaric Acid

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CATAPS5835267
CAS5835-26-7
Structure
MDL NumberMFCD04113116
SynonymsΔ7,15-Isopimaric acid,1-Phenanthrenecarboxylic acid, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,8,10,10a-dodecahydro-1,4a,7-trimethyl-, [1R-(1α,4aβ,4bα,7α,10aα)]-, 7,15-Isopimaradien-18-oic acid, Isopimaric acid A, Isopimaric acid (6CI), Podocarp-7-en-15-oic acid, 13β-methyl-13-vinyl-, (-)- (8CI), (+)-Isopimaric acid, Podocarp-7-en-15-oic acid, 13β-methyl-13-vinyl- (7CI), (1R,4aR,4bS,7S,10aR)-7-Ethenyl-1,2,3,4,4a,4b,5,6,7,8,10,10a-dodecahydro-1,4a,7-trimethyl-1-phenanthrenecarboxylic acid
IUPAC Name(1R,4aR,4bS,7S,10aR)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid
Molecular Weight302.45
Molecular FormulaC20H30O2
Canonical SMILESC[C@@]1(CC[C@H]2C(=CC[C@@H]3[C@]2(C)CCC[C@@]3(C)C(=O)O)C1)C=C
InChIInChI=1S/C20H30O2/c1-5-18(2)12-9-15-14(13-18)7-8-16-19(15,3)10-6-11-20(16,4)17(21)22/h5,7,15-16H,1,6,8-13H2,2-4H3,(H,21,22)/t15-,16+,18-,19+,20+/m0/s1
InChI KeyMXYATHGRPJZBNA-KRFUXDQASA-N
Description≥98% (GC), powder
SolubilityDMSO: 25 mg/mL
Accurate Mass302.2246
Assay≥98% (GC)
Colorwhite
Formpowder
FormatNeat
ShippingRoom Temperature
Size10MG
Storage Conditions-20°C Freezer
SubcategoryChiral molecules
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