Macrocarpal H

Inquiry
For Research Use Only.
Category
Sesquiterpene
Cat.No.
NP5748
CAS
179388-53-5
Product Name
Macrocarpal H
Structure
Structure

Product Details

Description
Macrocarpal H isolated from the branch of Eucalyptus globulus.
Synonyms
5-[1-[(1S,4aS,6R,8aS)-6-(2-hydroxypropan-2-yl)-8a-methyl-4-methylidene-1,2,3,4a,5,6,7,8-octahydronaphthalen-1-yl]-3-methylbutyl]-2,4,6-trihydroxybenzene-1,3-dicarbaldehyde
IUPAC Name
5-[(1S)-1-[(1S,4aS,6R,8aS)-6-(2-hydroxypropan-2-yl)-8a-methyl-4-methylidene-1,2,3,4a,5,6,7,8-octahydronaphthalen-1-yl]-3-methylbutyl]-2,4,6-trihydroxybenzene-1,3-dicarbaldehyde
Molecular Weight
472.6
Molecular Formula
C28H40O6
Canonical SMILES
CC(C)CC(C1CCC(=C)C2C1(CCC(C2)C(C)(C)O)C)C3=C(C(=C(C(=C3O)C=O)O)C=O)O
InChI
InChI=1S/C28H40O6/c1-15(2)11-18(23-25(32)19(13-29)24(31)20(14-30)26(23)33)21-8-7-16(3)22-12-17(27(4,5)34)9-10-28(21,22)6/h13-15,17-18,21-22,31-34H,3,7-12H2,1-2,4-6H3/t17-,18+,21+,22+,28+/m1/s1
InChIKey
OOAOETHJYYAVCC-GNLPDQNGSA-N
Boiling Point
543.8±50.0 °C(Predicted)
Purity
> 95%
Density
1.20±0.1 g/cm3(Predicted)
Appearance
Yellow powder
Application
anti-fouling activity; anti-bacterial activity
pKa
5.39±0.50(Predicted)
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