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CHEBI:40519 - adamantane

ChEBI IDCHEBI:40519
ChEBI Nameadamantane
Stars
Secondary ChEBI IDsCHEBI:33183, CHEBI:40514
Last Modified29 March 2012
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC10H16
Net Charge0
Average Mass136.238
Monoisotopic Mass136.12520
SMILESC1C2CC3CC1CC(C2)C3
InChIInChI=1S/C10H16/c1-7-2-9-4-8(1)5-10(3-7)6-9/h7-10H,1-6H2
InChIKeyORILYTVJVMAKLC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
adamantane (CHEBI:40519) is a adamantanes (CHEBI:51339)
adamantane (CHEBI:40519) is a polycyclic alkane (CHEBI:35713)
Incoming Relation(s)
1-methyladamantane (CHEBI:39004) has parent hydride adamantane (CHEBI:40519)
1,3-dimethyladamantane (CHEBI:47900) has parent hydride adamantane (CHEBI:40519)
adamantan-1-aminium (CHEBI:48320) has parent hydride adamantane (CHEBI:40519)
adamantanol (CHEBI:48579) has parent hydride adamantane (CHEBI:40519)
adamantanones (CHEBI:22235) has parent hydride adamantane (CHEBI:40519)
amantadine (CHEBI:2618) has parent hydride adamantane (CHEBI:40519)
memantine (CHEBI:64312) has parent hydride adamantane (CHEBI:40519)
perfluoroadamantane (CHEBI:39002) has parent hydride adamantane (CHEBI:40519)
adamantan-2-yl group (CHEBI:48078) is substituent group from adamantane (CHEBI:40519)
IUPAC Name 
adamantane
Synonyms  Source
tricyclo[3.3.1.13,7]decaneIUPAC
ADAMANTANEPDBeChem
AdamantanChEBI
Manual XrefsDatabases
ADMPDBeChem
DB03627DrugBank
Registry NumbersSources
Gmelin:26963Gmelin
Beilstein:1901173Beilstein
CAS:281-23-2ChemIDplus
CAS:281-23-2NIST Chemistry WebBook