CHEBI:222104 - 15alpha-Hydroxy-14-aldehyde probotryan-4

ChEBI IDCHEBI:222104
ChEBI Name15alpha-Hydroxy-14-aldehyde probotryan-4
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O2
Net Charge0
Average Mass234.339
Monoisotopic Mass234.16198
SMILESC[C@@H]1CC=C2[C@@H]3[C@H]1CC(O)[C@@]3(C=O)CC2(C)C
InChIInChI=1S/C15H22O2/c1-9-4-5-11-13-10(9)6-12(17)15(13,8-16)7-14(11,2)3/h5,8-10,12-13,17H,4,6-7H2,1-3H3/t9-,10+,12?,13+,15+/m1/s1
InChIKeyPDQCQIKOOSJLFX-XMLUMMTISA-N
Species of MetaboliteComponentSourceComments
Geniculosporium (ncbitaxon:1479502) - PubMed (15787444)
ChEBI Ontology
Outgoing Relation(s)
15alpha-Hydroxy-14-aldehyde probotryan-4 (CHEBI:222104) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(4R,7S,8R,11S)-5-hydroxy-2,2,8-trimethyltricyclo[5.3.1.04,11]undec-1(10)-ene-4-carbaldehyde
Manual XrefsDatabases
10480592ChemSpider