CHEBI:138165 - (+)-(2S,3R,9R)-pristinol

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ChEBI Name (+)-(2S,3R,9R)-pristinol
ChEBI ID CHEBI:138165
ChEBI ASCII Name (+)-(2S,3R,9R)-pristinol
Definition A bicyclic sesquiterpenoid that is 2,3,5,6,7,8,9,9a-octahydro-1H-cyclopenta[8]annulen-6-ol carrying four additional methyl substiuents at positions 1, 4, 8 and 8.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C15H26O
Net Charge 0
Average Mass 222.367
Monoisotopic Mass 222.19837
InChI InChI=1S/C15H26O/c1-10-5-6-13-11(2)7-12(16)8-15(3,4)9-14(10)13/h10,12,14,16H,5-9H2,1-4H3/b13-11-/t10-,12+,14+/m1/s1
InChIKey PXKJCWZAMAFFIW-GLBIRDDMSA-N
SMILES [C@]12(CC(C[C@H](CC(=C1CC[C@H]2C)C)O)(C)C)[H]
Metabolite of Species Details
Streptomyces pristinaespiralis (NCBI:txid38300) See: PubMed
Roles Classification
Biological Role(s): bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
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ChEBI Ontology
Outgoing (+)-(2S,3R,9R)-pristinol (CHEBI:138165) has role bacterial metabolite (CHEBI:76969)
(+)-(2S,3R,9R)-pristinol (CHEBI:138165) is a carbobicyclic compound (CHEBI:36785)
(+)-(2S,3R,9R)-pristinol (CHEBI:138165) is a homoallylic alcohol (CHEBI:134362)
(+)-(2S,3R,9R)-pristinol (CHEBI:138165) is a secondary alcohol (CHEBI:35681)
(+)-(2S,3R,9R)-pristinol (CHEBI:138165) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name
(1R,3aZ,6R,9aS)-1,4,8,8-tetramethyl-2,3,5,6,7,8,9,9a-octahydro-1H-cyclopenta[8]annulen-6-ol
Synonyms Sources
(+)-(2S,3R,9R)-pristinol UniProt
(1R,6R,9aS)-1,4,8,8-tetramethyl-2,3,5,6,7,8,9,9a-octahydro-1H-cyclopenta[8]annulen-6-ol SUBMITTER
Manual Xref Database
CPD-20250 MetaCyc
View more database links
Citation Waiting for Citations Type Source
27403888 PubMed citation SUBMITTER
Last Modified
16 October 2017