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CHEBI:69177 - 18-hydroxymanool

Default Structure
ChEBI IDCHEBI:69177
ChEBI Name18-hydroxymanool
Stars
DefinitionA natural product found in Trigonostemon heterophyllus.
Last Modified22 September 2014
DownloadsMolfile
FormulaC20H34O2
Net Charge0
Average Mass306.490
Monoisotopic Mass306.25588
SMILES[H][C@@]12CCC(=C)[C@H](CC[C@@](C)(O)C=C)[C@@]1(C)CCCC2(C)CO
InChIInChI=1S/C20H34O2/c1-6-19(4,22)13-10-16-15(2)8-9-17-18(3,14-21)11-7-12-20(16,17)5/h6,16-17,21-22H,1-2,7-14H2,3-5H3/t16-,17-,18?,19-,20+/m0/s1
InChIKeyIERFAZQCIAZODG-XIBWBMNSSA-N
Species of MetaboliteComponentSourceComments
Trigonostemon heterophyllus (IPNI:358015-1) twig (BTO:0001411) PubMed (22122667) 95% EtOH extract of powdered and air-dried twigs
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
18-hydroxymanool (CHEBI:69177) has role metabolite (CHEBI:25212)
18-hydroxymanool (CHEBI:69177) is a diterpenoid (CHEBI:23849)
Synonym  Source
Labda-8(20),14-diene-13,19-diolChEBI
Citations