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CHEBI:225271 - Drophiobolin B

ChEBI IDCHEBI:225271
ChEBI NameDrophiobolin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H34O4
Net Charge0
Average Mass398.543
Monoisotopic Mass398.24571
SMILESCC(C)=C[C@H]1C[C@H](C)[C@]2(CC[C@]3(C)C[C@@H]4C(C)=CC(=O)C4=C(CO)C(=O)C[C@H]32)O1
InChIInChI=1S/C25H34O4/c1-14(2)8-17-10-16(4)25(29-17)7-6-24(5)12-18-15(3)9-21(28)23(18)19(13-26)20(27)11-22(24)25/h8-9,16-18,22,26H,6-7,10-13H2,1-5H3/t16-,17-,18+,22+,24+,25-/m0/s1
InChIKeyVSGIUTNUGKJBMM-DSRQLINDSA-N
Species of MetaboliteComponentSourceComments
Bipolaris gigantea (ncbitaxon:2695822) - PubMed (33074690)
ChEBI Ontology
Outgoing Relation(s)
Drophiobolin B (CHEBI:225271) is a sesterterpenoid (CHEBI:26660)
IUPAC Name 
(1'R,2S,3S,3'R,5R,11'R)-8'-(hydroxymethyl)-1',3,4'-trimethyl-5-(2-methylprop-1-enyl)spiro[oxolane-2,12'-tricyclo[9.3.0.03,7]tetradeca-4,7-diene]-6',9'-dione