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butixirate

chemical compound
ChemicalSubstance group_of_stereoisomers Q27269320
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butixirate

Summary

butixirate is a group of stereoisomers[1].

Key Facts

  • butixirate's instance of is recorded as group of stereoisomers[2].
  • butixirate's CAS Registry Number is recorded as 19992-80-4[3].
  • butixirate's EC number is recorded as 243-454-7[4].
  • butixirate's canonical SMILES is recorded as CCC(C(=O)O)C1=CC=C(C=C1)C2=CC=CC=C2.C1=CC=C(C=C1)C2CCC(CC2)N[5].
  • butixirate's InChI is recorded as InChI=1S/C16H16O2.C12H17N/c1-2-15(16(17)18)14-10-8-13(9-11-14)12-6-4-3-5-7-12;13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h3-11,15H,2H2,1H3,(H,17,18);1-5,11-12H,6-9,13H2/t;11-,12-[6].
  • butixirate's InChIKey is recorded as KWFFVBCJCQQAIV-CLVGDUISSA-N[7].
  • butixirate's chemical formula is recorded as C₂₈H₃₃NO₂[8].
  • butixirate's subclass of is recorded as chemical compound[9].
  • butixirate's UNII is recorded as 82CYO8A460[10].
  • butixirate's ChemSpider ID is recorded as 16736841[11].
  • butixirate's isomeric SMILES is recorded as CCC(C(=O)O)C1=CC=C(C=C1)C2=CC=CC=C2.C1=CC=C(C=C1)[C@H]2CCC@@HNC@@HN">[12].
  • butixirate's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+415.251129'}[13].
  • butixirate's ECHA Substance Infocard ID is recorded as 100.039.489[14].
  • butixirate's SureChEMBL ID is recorded as 120698[15].
  • butixirate's DSSTox substance ID is recorded as DTXSID60941965[16].
  • butixirate's DSSTOX compound identifier is recorded as DTXCID601370385[17].

References

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

Direct Wikidata claims

  1. [2] ↑ . wikidata.org.
  2. [3] ↑ . Global Substance Registration System. Retrieved . commonchemistry.cas.org. Provenance: wikidata.org.
  3. [4] ↑ . Global Substance Registration System. Retrieved . wikidata.org.
  4. [5] ↑ . Global Substance Registration System. Retrieved . wikidata.org.
  5. [6] ↑ . Global Substance Registration System. Retrieved . wikidata.org.
  6. [7] ↑ . Global Substance Registration System. Retrieved . wikidata.org.
  7. [8] ↑ . wikidata.org.
  8. [9] ↑ . wikidata.org.
  9. [10] ↑ . Global Substance Registration System. Retrieved . wikidata.org.
  10. [11] ↑ . Q2311683. Retrieved . wikidata.org.
  11. [12] ↑ . Global Substance Registration System. Retrieved . wikidata.org.
  12. [13] ↑ . Q2311683. Retrieved . wikidata.org.
  13. [14] ↑ . ECHA Substance Infocard database. Retrieved . wikidata.org.
  14. [15] ↑ . wikidata.org.
  15. [16] ↑ . wikidata.org.
  16. [17] ↑ . wikidata.org.

Class ancestry

  1. [1] ↑ . Wikidata. wikidata.org.

📑 Cite this page

Use these citations when quoting this entity in research, articles, AI prompts, or wherever provenance matters. We aggregate Wikidata + Wikipedia + authoritative open-data sources; the stitched, scored, cross-referenced view is what 4ort.xyz contributes.

APA 4ort.xyz Knowledge Graph. (2026). butixirate. Retrieved May 3, 2026, from https://4ort.xyz/entity/butixirate
MLA “butixirate.” 4ort.xyz Knowledge Graph, 4ort.xyz, 3 May. 2026, https://4ort.xyz/entity/butixirate.
BibTeX @misc{4ortxyz_butixirate_2026, author = {{4ort.xyz Knowledge Graph}}, title = {{butixirate}}, year = {2026}, url = {https://4ort.xyz/entity/butixirate}, note = {Accessed: 2026-05-03}}
LLM prompt According to 4ort.xyz Knowledge Graph (aggregator of Wikidata, Wikipedia, and authoritative open-data sources): butixirate — https://4ort.xyz/entity/butixirate (retrieved 2026-05-03)

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