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aloin

chemical compound
ChemicalSubstance group_of_stereoisomers Q27140379
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aloin

Summary

aloin is a group of stereoisomers[1].

Key Facts

  • aloin's instance of is recorded as group of stereoisomers[2].
  • aloin's chemical structure is recorded as Aloin.svg[3].
  • aloin's canonical SMILES is recorded as C1=CC2=C(C(=C1)O)C(=O)C3=C(C=C(C=C3C2C4C(C(C(C(O4)CO)O)O)O)CO)O[4].
  • aloin's InChI is recorded as InChI=1S/C21H22O9/c22-6-8-4-10-14(21-20(29)19(28)17(26)13(7-23)30-21)9-2-1-3-11(24)15(9)18(27)16(10)12(25)5-8/h1-5,13-14,17,19-26,28-29H,6-7H2/t13-,14?,17-,19+,20-,21+/m1/s1[5].
  • aloin's InChIKey is recorded as AFHJQYHRLPMKHU-CGISPIQUSA-N[6].
  • aloin's chemical formula is recorded as C₂₁H₂₂O₉[7].
  • aloin's subclass of is recorded as chemical compound[8].
  • aloin's ChEMBL ID is recorded as CHEMBL497001[9].
  • aloin's ChemSpider ID is recorded as 8042387[10].
  • aloin's PubChem CID is recorded as 9866696[11].
  • aloin's ChEBI ID is recorded as 73222[12].
  • aloin's DrugBank ID is recorded as DB15477[13].
  • aloin's Reaxys registry number is recorded as 6077558[14].
  • aloin's Reaxys registry number is recorded as 1443124[15].
  • aloin's isomeric SMILES is recorded as C1=CC2=C(C(=C1)O)C(=O)C3=C(C=C(C=C3C2[C@H]4C@@HO)CO)OC@@HO)CO)O">[16].
  • aloin's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+418.126382'}[17].
  • aloin's SureChEMBL ID is recorded as 4974144[18].
  • aloin's UniChem compound ID is recorded as 203963[19].
  • aloin's Probes And Drugs ID is recorded as PD001478[20].

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] ↑ . PubChem. Retrieved . wikidata.org.
  4. [5] ↑ . PubChem. Retrieved . wikidata.org.
  5. [6] ↑ . PubChem. Retrieved . wikidata.org.
  6. [7] ↑ . PubChem. Retrieved . wikidata.org.
  7. [8] ↑ . wikidata.org.
  8. [9] ↑ . ChEMBL. Retrieved . wikidata.org.
  9. [10] ↑ . Q2311683. Retrieved . wikidata.org.
  10. [11] ↑ . PubChem. Retrieved . wikidata.org.
  11. [12] ↑ . ChEBI. Retrieved . wikidata.org.
  12. [13] ↑ . wikidata.org.
  13. [14] ↑ . ChEBI. Retrieved . wikidata.org.
  14. [15] ↑ . ChEBI. Retrieved . wikidata.org.
  15. [16] ↑ . PubChem. Retrieved . wikidata.org.
  16. [17] ↑ . PubChem. Retrieved . wikidata.org.
  17. [18] ↑ . wikidata.org.
  18. [19] ↑ . UniChem. wikidata.org.
  19. [20] ↑ . 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). aloin. Retrieved May 3, 2026, from https://4ort.xyz/entity/aloin-q27140379
MLA “aloin.” 4ort.xyz Knowledge Graph, 4ort.xyz, 3 May. 2026, https://4ort.xyz/entity/aloin-q27140379.
BibTeX @misc{4ortxyz_aloin-q27140379_2026, author = {{4ort.xyz Knowledge Graph}}, title = {{aloin}}, year = {2026}, url = {https://4ort.xyz/entity/aloin-q27140379}, note = {Accessed: 2026-05-03}}
LLM prompt According to 4ort.xyz Knowledge Graph (aggregator of Wikidata, Wikipedia, and authoritative open-data sources): aloin — https://4ort.xyz/entity/aloin-q27140379 (retrieved 2026-05-03)

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