1,2-ETHANEDIOL

Isomeric SMILES

C(CO)O

InChI

Not curated

{
  "aliases": [
    "1,2-ETHANEDIOL"
  ],
  "ccd_ids": [
    "EDO"
  ],
  "ccd_names": "[\"1,2-ETHANEDIOL\"]",
  "ccd_types": "[\"non-polymer\"]",
  "chemical_id": "INCHIKEY:LYCAIKOWRPUZTN-UHFFFAOYSA-N",
  "connectivity_block": "LYCAIKOWRPUZTN",
  "curated_source_sha256": null,
  "curation_version": "frozen-v1.2",
  "external_identifiers": {},
  "formal_charge_by_ccd": "{\"EDO\": 0}",
  "formulae": "[\"C2 H6 O2\"]",
  "geometry_note": "CCD ideal SDF is a reference chemical geometry, not a deposited bound pose.",
  "identity_status": "complete_deposited_InChIKey",
  "inchikey": "LYCAIKOWRPUZTN-UHFFFAOYSA-N",
  "inventory_origin": "v1_CCD_inventory",
  "isomeric_smiles": "C(CO)O",
  "primary_name": "1,2-ETHANEDIOL",
  "retrieval_date": "2026-10-24",
  "smiles_stereo_by_ccd": "{\"EDO\": \"C(CO)O\"}",
  "source_metadata_sha256": "{\"EDO\": \"96410f9df479d97e8aeca10d39bf744cb735d2d489e2135b7d0ee0947ff336d6\"}",
  "source_urls": [
    "https://www.rcsb.org/ligand/EDO"
  ]
}