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CHEBI:211506 - Aspergiloid D

ChEBI IDCHEBI:211506
ChEBI NameAspergiloid D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H32O3
Net Charge0
Average Mass320.473
Monoisotopic Mass320.23514
SMILESC=C[C@@]1(C)CC[C@H]2C(=C[C@H](O)[C@H]3C(C)(C)CC[C@@H](O)[C@]23C)[C@H]1O
InChIInChI=1S/C20H32O3/c1-6-19(4)10-7-13-12(17(19)23)11-14(21)16-18(2,3)9-8-15(22)20(13,16)5/h6,11,13-17,21-23H,1,7-10H2,2-5H3/t13-,14-,15+,16-,17+,19-,20-/m0/s1
InChIKeyOYKNTSVOOWIRJG-SEMYFXIOSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (22196792)
ChEBI Ontology
Outgoing Relation(s)
Aspergiloid D (CHEBI:211506) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(1S,2R,4aS,4bR,5R,8aS,9S)-2-ethenyl-2,4b,8,8-tetramethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthrene-1,5,9-triol
Manual XrefsDatabases
28496408ChemSpider