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CAS 79406-10-3

:

(3α,4α)-3-[[(2E)-1-Oxo-3-phenyl-2-propen-1-yl]oxy]kaur-16-en-18-oic acid

Description:
The chemical substance known as "(3α,4α)-3-[[(2E)-1-Oxo-3-phenyl-2-propen-1-yl]oxy]kaur-16-en-18-oic acid," with the CAS number 79406-10-3, is a complex organic compound that belongs to the class of kaurenoic acids, which are derived from the kaurene skeleton. This compound features a unique structure characterized by a kaurene backbone, which includes multiple stereocenters, contributing to its potential biological activity. The presence of a phenyl group and an α,β-unsaturated carbonyl moiety indicates that it may exhibit reactivity typical of such functional groups, potentially allowing for interactions with biological macromolecules. Its specific stereochemistry may influence its pharmacological properties, making it of interest in medicinal chemistry. Additionally, compounds of this nature are often studied for their potential applications in agriculture, particularly as plant growth regulators or in the development of novel therapeutic agents. However, detailed studies on its biological activity, toxicity, and environmental impact would be necessary to fully understand its characteristics and potential uses.
Formula:C29H36O4
InChI:InChI=1S/C29H36O4/c1-19-17-29-16-13-22-27(2,23(29)11-10-21(19)18-29)15-14-24(28(22,3)26(31)32)33-25(30)12-9-20-7-5-4-6-8-20/h4-9,12,21-24H,1,10-11,13-18H2,2-3H3,(H,31,32)/b12-9+/t21-,22+,23+,24-,27-,28+,29-/m1/s1
InChI key:InChIKey=BJQOPHXIKHSJOP-OLJRGKMISA-N
SMILES:C[C@]12[C@]3([C@]4(C[C@@](CC3)(C(=C)C4)[H])CC[C@@]1([C@@](C(O)=O)(C)[C@H](OC(/C=C/C5=CC=CC=C5)=O)CC2)[H])[H]
Synonyms:
  • Kaur-16-en-18-oic acid, 3-[(1-oxo-3-phenyl-2-propenyl)oxy]-, [3α(E),4α]-
  • Kaur-16-en-18-oic acid, 3-[[(2E)-1-oxo-3-phenyl-2-propen-1-yl]oxy]-, (3α,4α)-
  • (3α,4α)-3-[[(2E)-1-Oxo-3-phenyl-2-propen-1-yl]oxy]kaur-16-en-18-oic acid
  • Kaur-16-en-18-oic acid, 3-[[(2E)-1-oxo-3-phenyl-2-propenyl]oxy]-, (3α,4α)-
  • 3α-Cinnamoyloxy-ent-kaur-16-en-19-oic acid
  • ent-3β-Cinnamoyloxykaur-16-en-19-oic acid
  • ent-3β-CinnaMoyloxykaur-16-en-19-oicaci
  • ent-3beta-Cinnamoyloxykaur-16-en-19-oic acid
  • ENT-3Β-CINNAMOYLOXYKAUR-16-EN-19
  • ent-3β-CinnaMoyloxykaur-16-en-19-oic acid
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