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CAS 91794-15-9

:

(1α,6β,14α,16β)-20-Ethyl-1,16-dimethoxy-4-(methoxymethyl)aconitane-6,8,14-triol

Description:
The chemical substance known as "(1α,6β,14α,16β)-20-Ethyl-1,16-dimethoxy-4-(methoxymethyl)aconitane-6,8,14-triol," with the CAS number 91794-15-9, is a complex organic compound belonging to the class of alkaloids, specifically derived from the Aconitum genus, commonly known as monkshood or wolfsbane. This compound features a multi-ring structure characteristic of many alkaloids, with multiple functional groups including methoxy and hydroxyl groups, which contribute to its chemical reactivity and potential biological activity. The presence of these functional groups suggests that it may exhibit various pharmacological properties, although specific biological activities would require further investigation. The stereochemistry indicated by the nomenclature suggests specific spatial arrangements of atoms, which can significantly influence the compound's interactions with biological systems. Overall, this compound represents a unique structure within the realm of natural products, with potential implications in medicinal chemistry and pharmacology.
Formula:C24H39NO6
InChI:InChI=1S/C24H39NO6/c1-5-25-10-22(11-29-2)7-6-15(31-4)24-13-8-12-14(30-3)9-23(28,16(13)18(12)26)17(21(24)25)19(27)20(22)24/h12-21,26-28H,5-11H2,1-4H3/t12-,13-,14+,15+,16-,17+,18+,19-,20-,21-,22+,23-,24+/m1/s1
InChI key:InChIKey=AUFPYCWNRDFSAE-YXQJRNGSSA-N
SMILES:O(C)[C@@H]1[C@@]23[C@]4([C@](COC)(CN(CC)[C@@]2([C@]([C@H]4O)([C@]5(O)[C@@]6([C@]3(C[C@@]([C@@H]6O)([C@@H](OC)C5)[H])[H])[H])[H])[H])CC1)[H]
Synonyms:
  • O6-Demethylchasmanine
  • Aconitane-6,8,14-triol, 20-ethyl-1,16-dimethoxy-4-(methoxymethyl)-, (1α,6β,14α,16β)-
  • (1α,6β,14α,16β)-20-Ethyl-1,16-dimethoxy-4-(methoxymethyl)aconitane-6,8,14-triol
  • Longtouconitine B
  • Foresticine
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