EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:212343 - Bipolarin H

ChEBI IDCHEBI:212343
ChEBI NameBipolarin H
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H38O3
Net Charge0
Average Mass386.576
Monoisotopic Mass386.28210
SMILESCC(C)=C[C@H]1C[C@H](C)[C@]2(CC[C@]3(C)C[C@@H]4C(C)=CC(=O)[C@H]4[C@H](CO)CC[C@H]32)O1
InChIInChI=1S/C25H38O3/c1-15(2)10-19-12-17(4)25(28-19)9-8-24(5)13-20-16(3)11-21(27)23(20)18(14-26)6-7-22(24)25/h10-11,17-20,22-23,26H,6-9,12-14H2,1-5H3/t17-,18-,19-,20+,22+,23-,24+,25-/m0/s1
InChIKeyAEUKKOBDPBWXRW-USVNYHNNSA-N
Species of MetaboliteComponentSourceComments
Bipolaris (ncbitaxon:33194) - DOI (10.1016/S1875-5364(19)30116-5)
ChEBI Ontology
Outgoing Relation(s)
Bipolarin H (CHEBI:212343) is a sesterterpenoid (CHEBI:26660)
IUPAC Name 
(1'R,2S,3S,3'S,5R,7'R,8'R,11'R)-8'-(hydroxymethyl)-1',3,4'-trimethyl-5-(2-methylprop-1-enyl)spiro[oxolane-2,12'-tricyclo[9.3.0.03,7]tetradec-4-ene]-6'-one