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CAS 1231-74-9

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Methyl (1S,4aS,10aR)-1,2,3,4,4a,9,10,10a-octahydro-6-methoxy-1,4a-dimethyl-1-phenanthrenecarboxylate

Description:
Methyl (1S,4aS,10aR)-1,2,3,4,4a,9,10,10a-octahydro-6-methoxy-1,4a-dimethyl-1-phenanthrenecarboxylate, with CAS number 1231-74-9, is a complex organic compound characterized by its polycyclic structure, which includes a phenanthrene core. This compound features multiple stereocenters, contributing to its specific three-dimensional configuration, which is crucial for its biological activity and interactions. The presence of a methoxy group and a carboxylate ester functional group indicates potential reactivity and solubility characteristics, making it of interest in various chemical applications, including medicinal chemistry. Its octahydro structure suggests it is a saturated derivative, which may influence its stability and reactivity compared to unsaturated analogs. The compound's unique stereochemistry and functional groups may also impart specific pharmacological properties, making it a candidate for further research in drug development or as a biochemical probe. Overall, this compound exemplifies the complexity and diversity found in organic chemistry, particularly in the realm of natural product derivatives.
Formula:C19H26O3
InChI:InChI=1S/C19H26O3/c1-18-10-5-11-19(2,17(20)22-4)16(18)9-7-13-6-8-14(21-3)12-15(13)18/h6,8,12,16H,5,7,9-11H2,1-4H3/t16-,18-,19+/m1/s1
InChI key:InChIKey=BSKWXDWRTACMCC-QRQLOZEOSA-N
SMILES:C[C@@]12[C@]([C@](C(OC)=O)(C)CCC1)(CCC=3C2=CC(OC)=CC3)[H]
Synonyms:
  • Podocarpa-8,11,13-trien-16-oic acid, 12-methoxy-, methyl ester
  • Methyl (1S,4aS,10aR)-1,2,3,4,4a,9,10,10a-octahydro-6-methoxy-1,4a-dimethyl-1-phenanthrenecarboxylate
  • Methyl O-methylpodocarpate
  • 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-6-methoxy-1,4a-dimethyl-, methyl ester, (1S,4aS,10aR)-
  • 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-6-methoxy-1,4a-dimethyl-, methyl ester, [1S-(1α,4aα,10aβ)]-
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