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CAS 100288-36-6

:

(3aR,4S,5S,8R,8aR)-1,2,3,3a,4,5,8,8a-Octahydro-4-hydroxy-2,2,8-trimethyl-5,6-azulenedicarboxaldehyde

Description:
The chemical substance with the name "(3aR,4S,5S,8R,8aR)-1,2,3,3a,4,5,8,8a-Octahydro-4-hydroxy-2,2,8-trimethyl-5,6-azulenedicarboxaldehyde" and CAS number "100288-36-6" is a complex organic compound characterized by its unique bicyclic structure and multiple functional groups. It features a hydroxyl group and two aldehyde groups, contributing to its reactivity and potential applications in organic synthesis. The presence of multiple methyl groups enhances its hydrophobic characteristics, influencing its solubility and interaction with biological systems. The stereochemistry indicated by the specific configuration at various chiral centers suggests that this compound may exhibit distinct biological activity, potentially making it relevant in fields such as medicinal chemistry or natural product research. Its azulene-like framework may also impart interesting optical properties. Overall, this compound's intricate structure and functional diversity make it a subject of interest for further study in chemical and pharmaceutical applications.
Formula:C15H22O3
InChI:InChI=1S/C15H22O3/c1-9-4-10(7-16)13(8-17)14(18)12-6-15(2,3)5-11(9)12/h4,7-9,11-14,18H,5-6H2,1-3H3/t9-,11+,12+,13-,14-/m0/s1
InChI key:InChIKey=XXMVNOYKYOCDTD-OMRNGCIESA-N
SMILES:O[C@H]1[C@]2([C@@]([C@@H](C)C=C(C=O)[C@@H]1C=O)(CC(C)(C)C2)[H])[H]
Synonyms:
  • Piperdial
  • 5,6-Azulenedicarboxaldehyde, 1,2,3,3a,4,5,8,8a-octahydro-4-hydroxy-2,2,8-trimethyl-, [3aR-(3aα,4α,5β,8α,8aα)]-
  • (+)-Piperdial
  • 5,6-Azulenedicarboxaldehyde, 1,2,3,3a,4,5,8,8a-octahydro-4-hydroxy-2,2,8-trimethyl-, (3aR,4S,5S,8R,8aR)-
  • (3aR,4S,5S,8R,8aR)-1,2,3,3a,4,5,8,8a-Octahydro-4-hydroxy-2,2,8-trimethyl-5,6-azulenedicarboxaldehyde
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