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CAS 1401419-87-1

:

(4α)-13-Hydroxy-15-oxokaura-9(11),16-dien-18-oic acid

Description:
(4α)-13-Hydroxy-15-oxokaura-9(11),16-dien-18-oic acid, identified by its CAS number 1401419-87-1, is a chemical compound that belongs to the class of terpenoids, specifically a type of kaurene derivative. This compound features a complex bicyclic structure characterized by multiple functional groups, including a hydroxyl group and a ketone, which contribute to its reactivity and potential biological activity. The presence of the hydroxyl group suggests that it may participate in hydrogen bonding, influencing its solubility and interaction with biological systems. The compound's unique double bond configuration and the presence of a carboxylic acid functional group may also play a role in its chemical behavior and potential applications in medicinal chemistry. While specific biological activities may vary, compounds of this nature are often investigated for their potential therapeutic effects, including anti-inflammatory and anticancer properties. Further research is necessary to fully elucidate its pharmacological profile and potential uses in various fields, including pharmaceuticals and natural product chemistry.
Formula:C20H26O4
InChI:InChI=1S/C20H26O4/c1-12-15(21)19-9-5-13-17(2,7-4-8-18(13,3)16(22)23)14(19)6-10-20(12,24)11-19/h6,13,24H,1,4-5,7-11H2,2-3H3,(H,22,23)/t13-,17+,18+,19+,20-/m0/s1
InChI key:InChIKey=MOEGAVNUGPZNDZ-OBHGLWADSA-N
SMILES:O=C1[C@]23C([C@@]4(C)[C@](CC2)([C@@](C(O)=O)(C)CCC4)[H])=CC[C@](O)(C3)C1=C
Synonyms:
  • (4α)-13-Hydroxy-15-oxokaura-9(11),16-dien-18-oic acid
  • Kaura-9(11),16-dien-18-oic acid, 13-hydroxy-15-oxo-, (4α)-
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