External References (24)
Cas registry number
443-79-8
Chebi id
38264
Chembl id
CHEMBL297800
Chemspider id
769
Dsstox compound identifier
DTXCID201323037
Dsstox substance id
DTXSID2046882, DTXSID80901480
Ec number
207-139-8
Echa substance infocard id
100.006.492
Fl number
17.010
Human metabolome database id
HMDB0033923
Inchi
InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)
Inchikey
AGPKZVBTJJNPAG-UHFFFAOYSA-N
Jecfa number
1422
Kegg id
C16434
Massbank accession id
MSBNK-Athens_Univ-AU515307, MSBNK-Metabolon-MT000039, MSBNK-MPI_for_Chemical_Ecology-CE000609, MSBNK-MPI_for_Chemical_Ecology-CE000610, MSBNK-MPI_for_Chemical_Ecology-CE000611, MSBNK-MPI_for_Chemical_Ecology-CE000612, MSBNK-MPI_for_Chemical_Ecology-CE000613, MSBNK-MPI_for_Chemical_Ecology-CE000614, MSBNK-MPI_for_Chemical_Ecology-CE000615, MSBNK-MPI_for_Chemical_Ecology-CE000616, MSBNK-MPI_for_Chemical_Ecology-CE000617, MSBNK-MPI_for_Chemical_Ecology-CE000618, MSBNK-MPI_for_Chemical_Ecology-CE000619, MSBNK-MPI_for_Chemical_Ecology-CE000620, MSBNK-IPB_Halle-PB000395, MSBNK-IPB_Halle-PB000396, MSBNK-IPB_Halle-PB000397, MSBNK-IPB_Halle-PB000398
Nmrshiftdb structure id
10016958
Nsc number
9958
Probes and drugs id
PD055165
Pubchem cid
791, 57397079
Reaxys registry number
1721790
Splash
splash10-000i-9100000000-86db4653452734c7ee02, splash10-00kr-9000000000-b5193c14ac1b83a826f8, splash10-0a4l-9000000000-fe2b891ad2e6f480f0e0, splash10-000i-9000000000-e3563316bf8abf9b350e, splash10-001r-5900000000-d1d68f4749ada07de247, splash10-001r-7900000000-dfc616c406406a090017, splash10-0019-9800000000-791a972f9062e1e1eecc, splash10-0019-9500000000-a332ad6eee44c4497d8f, splash10-000i-9000000000-8d985ce33021a1b4c84a, splash10-000i-9000000000-3dcd45c5f171baffc70d, splash10-000i-9000000000-a9179cc22b0f645e95d5, splash10-001i-1900000000-8f46b9e93a85ffd492cf, splash10-0019-9500000000-d4299ac653fc3b59494d, splash10-000i-9000000000-60845ad5e14aa30302f9, splash10-000i-9000000000-abdbfcab79f327c00e5a, splash10-001i-1900000000-99f9d7387d2d9e3ec421, splash10-001r-9400000000-be94679417dff84dfe6b, splash10-001i-0900000000-55eff9d9638f882c260f, splash10-000i-9000000000-1adf682852a4e642fdd7, splash10-000i-9000000000-f729102877cab544a68d, splash10-000i-9200000000-5690865bab18b5b529cd, splash10-0a4i-0910000000-5bb0521c0ebf8a910a75
Surechembl id
8868
Unichem compound id
335787
Unii
5HX0BYT4E3