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CAS 135359-41-0

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1H-Indene-1-pentanoic acid, octahydro-δ,7a-dimethyl-4-oxo-, methyl ester, [1R-[1α(R*),3aβ,7aα]]-

Description:
1H-Indene-1-pentanoic acid, octahydro-δ,7a-dimethyl-4-oxo-, methyl ester, with CAS number 135359-41-0, is a chemical compound characterized by its complex structure, which includes an indene ring fused with a pentanoic acid moiety. This compound features a methyl ester functional group, indicating it is an ester derivative, which typically enhances its solubility in organic solvents. The presence of multiple chiral centers suggests that it may exhibit stereoisomerism, potentially influencing its biological activity and interactions. The octahydro structure indicates that it is a saturated compound, which may contribute to its stability and reactivity. Such compounds are often studied for their potential applications in pharmaceuticals, agrochemicals, or as intermediates in organic synthesis. The specific stereochemistry, denoted by the [1R-[1α(R*),3aβ,7aα]] notation, implies that the compound may have unique properties based on its three-dimensional arrangement, which can significantly affect its chemical behavior and interactions with biological systems.
Formula:C17H28O3
InChI:InChI=1S/C17H28O3/c1-12(6-4-8-16(19)20-3)13-9-10-14-15(18)7-5-11-17(13,14)2/h12-14H,4-11H2,1-3H3/t12-,13-,14+,17-/m1/s1
InChI key:InChIKey=YDDSWVLLFYZHGD-VWPFQQQWSA-N
SMILES:C[C@@]12[C@@]([C@@H](CCCC(OC)=O)C)(CC[C@]1(C(=O)CCC2)[H])[H]
Synonyms:
  • 1H-Indene-1-pentanoic acid, octahydro-δ,7a-dimethyl-4-oxo-, methyl ester, [1R-[1α(R*),3aβ,7aα]]-
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