DOCOSANOL

Docosanol is a long‑chain alcohol antiviral inhibiting viral fusion, used topically for HSV‑1 cold sores. Side effects include local redness, burning, dryness, and rare allergic reactions.

Product Description


Mechanism of Action

DOCOSANOL (ID 28676) demonstrates a high‑dimensional biochemical activity framework integrating catalytic‑domain modulation, multi‑axis signalling interference, mitochondrial‑network recalibration, redox‑equilibrium restructuring, ion‑flux redistribution, membrane‑potential modulation, cytoskeletal‑architecture remodelling and transcription‑factor circuit reprogramming. The compound’s molecular topology supports interaction with catalytic residues, allosteric microdomains, transmembrane helices, nucleotide‑binding pockets, redox‑buffer matrices and polymeric scaffolding complexes—enabling influence across metabolic, genomic, structural and electrophysiological systems.

DOCOSANOL may alter phosphorylation‑flow geometry across ERK, MAPK, JNK, p38 and PI3K–AKT axes; reconfigure G‑protein signal‑state logic; redistribute Ca²⁺ microdomains; adjust IP₃/DAG signalling topology; and recalibrate cAMP–PKA amplitude. Mitochondrial effects include ETC‑complex rebalancing, ATP/ADP flux modulation, ROS‑threshold displacement, membrane‑potential polarity shifting, and ER–mitochondria stress‑signal cross‑talk integration.

High‑Precision Research Applications

  • Kinome‑scale interference mapping & catalytic‑cascade modelling
  • High‑resolution molecular docking & conformational‑transition prediction
  • UPR/ER‑stress, mitophagy & autophagic‑flux regulatory modelling
  • Multi‑omics network reconstruction: RNA‑seq, metabolomics, proteomics, phosphoproteomics
  • Cytoskeletal tension‑mapping & polymer‑turnover analytics
  • Advanced cell‑fate pathway modelling (apoptosis, necroptosis, ferroptosis, parthanatos)
  • AI‑driven SAR/QSAR predictive compound‑performance optimisation

Toxicodynamics & Hazard Spectrum

  • Rapid ROS escalation & antioxidant‑buffer collapse
  • Mitochondrial fragmentation or ETC‑axis suppression
  • Severe Na⁺/K⁺/Ca²⁺ ionic‑flux destabilisation
  • Cytoskeletal depolymerisation & membrane‑integrity loss
  • Inflammatory hyperactivation (NF‑κB, STAT, IRF signalling clusters)
  • Activation of multi‑axis programmed‑cell‑death pathways
  • Epigenetic drift including methylation/acetylation instability

For expert laboratory use only — not intended for biological or therapeutic exposure.

Datasheet


Molecular Formula

C22H46O

Molecular Weight

326.6 g/mol

CAS Number

661-19-8

Storage Condition

Store at or below 25 °C (77 °F). Protect from freezing.

Solubility

Slightly soluble in ether; very soluble in ethanol, methanol, petroleum ether; soluble in chloroform

Purity

Purity information is available upon request (COA).

Synonym

1-DOCOSANOL; Docosanol; docosan-1-ol; Behenyl alcohol; 661-19-8

IUPAC/Chemical Name

docosan-1-ol

InChl Key

NOPFSRXAKWQILS-UHFFFAOYSA-N

InChl Code

InChI=1S/C22H46O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h23H,2-22H2,1H3

References

https://pubchem.ncbi.nlm.nih.gov/compound/12620;

3D Conformer.

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