Ketcher 01291817112D 1   1.00000     0.00000     0

  3  2  0     0  0            999 V2000
    3.8434  -32.8314    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8434  -31.8314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8434  -30.8314    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0     0  0
  2  3  2  0     0  0
M  END
> <ID>
CHEBI:16526

> <NAME>
carbon dioxide

> <DEFINITION>
A one-carbon compound with formula CO2 in which the carbon is attached to each oxygen atom by a double bond. A colourless, odourless gas under normal conditions, it is produced during respiration by all animals, fungi and microorganisms that depend directly or indirectly on living or decaying plants for food.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:48829; CHEBI:3283; CHEBI:13282; CHEBI:13283; CHEBI:13285; CHEBI:13284; CHEBI:23011

> <SYNONYM>
R-744; E290; E-290; E 290; CO(2); CO2; carbonic anhydride; CARBON DIOXIDE; Carbon dioxide; [CO2]

> <IUPAC_NAME>
methanedione; dioxidocarbon; carbon dioxide

> <FORMULA>
CO2

> <MASS>
44.010

> <MONOISOTOPIC_MASS>
43.98983

> <CHARGE>
0

> <SMILES>
O=C=O

> <INCHI>
InChI=1S/CO2/c2-1-3

> <INCHIKEY>
CURLTUGMZLYLDI-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
1900390

> <CAS_REGISTRY_NUMBER>
124-38-9

> <GMELIN_REGISTRY_NUMBER>
989

> <REAXYS_REGISTRY_NUMBER>
1900390

> <CHEMIDPLUS>
124-38-9

> <KEGG_COMPOUND_ACCESSION>
C00011

> <KEGG_DRUG_ACCESSION>
D00004

> <METACYC_ACCESSION>
CARBON-DIOXIDE

> <MOLBASE_ACCESSION>
752

> <NIST_CHEMISTRY_WEBBOOK>
124-38-9

> <PDBECHEM_ACCESSION>
CO2

> <WIKIPEDIA_ACCESSION>
Carbon_dioxide

> <PUBMED_CITATION>
10826146; 11094503; 11584085; 11802652; 14639145; 15050588; 16591971; 16656478; 16659660; 17190796; 17448243; 17878298; 17884085; 19043767; 19259576; 19854893; 23384758; 23828359; 24258718; 8482095; 8818713; 8869828; 9611769; 9730350

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