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1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol

chemical compound
ChemicalSubstance group_of_stereoisomers Q27166295
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1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol

Summary

1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol is a group of stereoisomers[1].

Key Facts

  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's instance of is recorded as group of stereoisomers[2].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's chemical structure is recorded as (±)-Stiripentol Structural Formulae V.1.svg[3].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's CAS Registry Number is recorded as 49763-96-4[4].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's canonical SMILES is recorded as CC(C)(C)C(C=CC1=CC2=C(C=C1)OCO2)O[5].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's InChI is recorded as InChI=1S/C14H18O3/c1-14(2,3)13(15)7-5-10-4-6-11-12(8-10)17-9-16-11/h4-8,13,15H,9H2,1-3H3[6].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's InChIKey is recorded as IBLNKMRFIPWSOY-UHFFFAOYSA-N[7].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's chemical formula is recorded as C₁₄H₁₈O₃[8].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's subclass of is recorded as phenylpropanoid[9].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's ChemSpider ID is recorded as 36136[10].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's ChemSpider ID is recorded as 21235181[11].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's PubChem CID is recorded as 39524[12].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's ChEBI ID is recorded as 94435[13].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's Human Metabolome Database ID is recorded as HMDB0246697[14].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+234.126'}[15].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's SureChEMBL ID is recorded as 2533815[16].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's SureChEMBL ID is recorded as 995287[17].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's DSSTox substance ID is recorded as DTXSID6049068[18].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's UniChem compound ID is recorded as 22794316[19].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's DrugCentral ID is recorded as 2480[20].
  • 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol's Probes And Drugs ID is recorded as PD073784[21].

References

Programmatic citations — every numbered marker resolves to a verifiable graph row below.

Direct Wikidata claims

  1. [2] ↑ . wikidata.org.
  2. [3] ↑ . wikidata.org.
  3. [4] ↑ . Chemical Abstracts Service. Retrieved . wikidata.org.
  4. [5] ↑ . PubChem. Retrieved . wikidata.org.
  5. [6] ↑ . PubChem. Retrieved . wikidata.org.
  6. [7] ↑ . PubChem. Retrieved . wikidata.org.
  7. [8] ↑ . PubChem. Retrieved . wikidata.org.
  8. [9] ↑ . wikidata.org.
  9. [10] ↑ . Q2311683. Retrieved . wikidata.org.
  10. [11] ↑ . Q2311683. Retrieved . wikidata.org.
  11. [12] ↑ . PubChem. Retrieved . wikidata.org.
  12. [13] ↑ . ChEBI. Retrieved . wikidata.org.
  13. [14] ↑ . wikidata.org.
  14. [15] ↑ . PubChem. Retrieved . wikidata.org.
  15. [16] ↑ . wikidata.org.
  16. [17] ↑ . wikidata.org.
  17. [18] ↑ . wikidata.org.
  18. [19] ↑ . UniChem. wikidata.org.
  19. [20] ↑ . UniChem. wikidata.org.
  20. [21] ↑ . wikidata.org.

Class ancestry

  1. [1] ↑ . Wikidata. wikidata.org.

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BibTeX @misc{4ortxyz_1-1-3-benzodioxol-5-yl-4-4-dimethyl-1-penten-3-ol_2026, author = {{4ort.xyz Knowledge Graph}}, title = {{1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-ol}}, year = {2026}, url = {https://4ort.xyz/entity/1-1-3-benzodioxol-5-yl-4-4-dimethyl-1-penten-3-ol}, note = {Accessed: 2026-05-03}}
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