EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:208710 - Ophiobolin Z

ChEBI IDCHEBI:208710
ChEBI NameOphiobolin Z
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H42O4
Net Charge0
Average Mass430.629
Monoisotopic Mass430.30831
SMILESCO[C@@H]1O[C@]2(OC)C[C@@](C)(O)[C@H]3C[C@@]4(C)CC[C@H]([C@@H](C)/C=C\C=C(C)C)[C@@H]4CC=C1[C@@H]32
InChIInChI=1S/C27H42O4/c1-17(2)9-8-10-18(3)19-13-14-25(4)15-22-23-20(11-12-21(19)25)24(29-6)31-27(23,30-7)16-26(22,5)28/h8-11,18-19,21-24,28H,12-16H2,1-7H3/b10-8-,20-11?/t18-,19+,21-,22-,23-,24+,25+,26+,27+/m0/s1
InChIKeyIJDXBTKKTDHRMD-VKPCNJBFSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (29286660)
ChEBI Ontology
Outgoing Relation(s)
Ophiobolin Z (CHEBI:208710) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1S,3R,6R,7S,11R,13R,15R,16R)-11,13-dimethoxy-3,15-dimethyl-6-[(2S,3Z)-6-methylhepta-3,5-dien-2-yl]-12-oxatetracyclo[8.5.1.03,7.013,16]hexadec-9-en-15-ol