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CAS 60129-65-9

:

Kaur-16-en-18-oic acid, 11-hydroxy-15-oxo-, β-D-glucopyranosyl ester, (4α,11β)-

Description:
Kaur-16-en-18-oic acid, 11-hydroxy-15-oxo-, β-D-glucopyranosyl ester, (4α,11β)-, with CAS number 60129-65-9, is a naturally occurring compound classified as a triterpenoid glycoside. This substance is derived from the kaurene family of compounds, which are known for their diverse biological activities. The structure features a kaurene backbone, characterized by a fused ring system and multiple functional groups, including a carboxylic acid and a hydroxyl group. The β-D-glucopyranosyl ester indicates that a glucose molecule is attached via a glycosidic bond, which can influence the solubility and bioactivity of the compound. Kaur-16-en-18-oic acid derivatives are often studied for their potential pharmacological properties, including anti-inflammatory and antitumor activities. The stereochemistry, denoted by (4α,11β)-, suggests specific spatial arrangements of atoms that can affect the compound's interaction with biological targets. Overall, this compound exemplifies the complexity and significance of natural products in medicinal chemistry and pharmacognosy.
Formula:C26H38O9
InChI:InChI=1S/C26H38O9/c1-12-13-9-14(28)20-24(2)6-4-7-25(3,16(24)5-8-26(20,10-13)21(12)32)23(33)35-22-19(31)18(30)17(29)15(11-27)34-22/h13-20,22,27-31H,1,4-11H2,2-3H3/t13-,14+,15-,16+,17-,18+,19-,20+,22+,24-,25-,26-/m1/s1
InChI key:InChIKey=JSKLOHJUYDOADP-DQGZFUNPSA-N
SMILES:C[C@]12[C@]3([C@]4(C[C@@](C[C@@H]3O)(C(=C)C4=O)[H])CC[C@@]1([C@@](C(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)=O)(C)CCC2)[H])[H]
Synonyms:
  • 1H-2,10a-Ethanophenanthrene,kaur-16-en-18-oic acid deriv.
  • Kaur-16-en-18-oic acid, 11-hydroxy-15-oxo-, β-<span class="text-smallcaps">D</span>-glucopyranosyl ester, (4α,11β)-
  • Paniculoside III
  • Kaur-16-en-18-oic acid, 11-hydroxy-15-oxo-, β-D-glucopyranosyl ester, (4α,11β)-
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