EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:28261 - (+)-α-pinene

ChEBI IDCHEBI:28261
ChEBI Name(+)-α-pinene
Stars
ASCII Name(+)-alpha-pinene
DefinitionThe (+)-enantiomer of α-pinene.
Secondary ChEBI IDsCHEBI:52, CHEBI:18437, CHEBI:46034
Last Modified23 October 2015
DownloadsMolfile
FormulaC10H16
Net Charge0
Average Mass136.238
Monoisotopic Mass136.12520
SMILESCC1=CC[C@@H]2C[C@H]1C2(C)C
InChIInChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3/t8-,9-/m1/s1
InChIKeyGRWFGVWFFZKLTI-RKDXNWHRSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
(+)-α-pinene (CHEBI:28261) has role human metabolite (CHEBI:77746)
(+)-α-pinene (CHEBI:28261) has role plant metabolite (CHEBI:76924)
(+)-α-pinene (CHEBI:28261) is a α-pinene (CHEBI:36740)
(+)-α-pinene (CHEBI:28261) is enantiomer of (−)-α-pinene (CHEBI:28660)
Incoming Relation(s)
(−)-α-pinene (CHEBI:28660) is enantiomer of (+)-α-pinene (CHEBI:28261)
IUPAC Names 
(1R,5R)-2,6,6-trimethylbicyclo[3.1.1]hept-2-ene
(1R,5R)-pin-2-ene
Synonyms  Source
(1R,5R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-eneKEGG COMPOUND
(+)-3,6,6-TRIMETHYLBICYCLO[3.1.1]HEPT-2-ENEPDBeChem
(+)-alpha-PineneKEGG COMPOUND
α-Pinene(dextro)NIST Chemistry WebBook
UniProt Name  Source
(1R,5R)-α-pineneUniProt
Manual XrefsDatabases
C06306KEGG COMPOUND
C06306KEGG COMPOUND
CPD-8754MetaCyc
HMDB0006525HMDB
LMPR0102120012LIPID MAPS
TMHPDBeChem
Registry NumbersSources
Reaxys:2038653Reaxys
CAS:7785-70-8NIST Chemistry WebBook
CAS:7785-70-8ChemIDplus
CAS:7785-70-8KEGG COMPOUND