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CHEBI:201352 - Antrodin D

Default Structure
ChEBI IDCHEBI:201352
ChEBI NameAntrodin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H28O
Net Charge0
Average Mass236.399
Monoisotopic Mass236.21402
SMILESC[C@H]1C[C@H]2[C@@H](O)[C@H]3CC(C)(C)C[C@H]3[C@]2(C)[C@H]1C
InChIInChI=1S/C16H28O/c1-9-6-12-14(17)11-7-15(3,4)8-13(11)16(12,5)10(9)2/h9-14,17H,6-8H2,1-5H3/t9-,10-,11-,12-,13+,14-,16+/m0/s1
InChIKeyJXTINQFFOKAJPL-CVEYVTCZSA-N
Species of MetaboliteComponentSourceComments
Cerrena albocinnamomea (ncbitaxon:2169404) - PubMed (25704368)
ChEBI Ontology
Outgoing Relation(s)
Antrodin D (CHEBI:201352) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(2S,3S,3aS,3bR,6aS,7S,7aR)-2,3,3a,5,5-pentamethyl-2,3,3b,4,6,6a,7,7a-octahydro-1H-cyclopenta[a]pentalen-7-ol
Manual XrefsDatabases
78442288ChemSpider