CHEBI:208386 - Lobarialide B

ChEBI IDCHEBI:208386
ChEBI NameLobarialide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H42O4
Net Charge0
Average Mass466.662
Monoisotopic Mass466.30831
SMILESCC(C)[C@H]1CC[C@@H]2[C@]1(C)CC[C@]1(C)[C@H]3CC[C@@H]4[C@]5(C[C@H]6OC(=O)[C@]4(C)[C@H]6OC5=O)C3=CC[C@@]21C
InChIInChI=1S/C30H42O4/c1-16(2)17-7-9-21-26(17,3)13-14-27(4)18-8-10-22-29(6)23-20(33-24(29)31)15-30(22,25(32)34-23)19(18)11-12-28(21,27)5/h11,16-18,20-23H,7-10,12-15H2,1-6H3/t17-,18+,20-,21-,22+,23+,26-,27-,28+,29+,30+/m1/s1
InChIKeyYIZWIUHPPVFEEQ-QOYIRNJZSA-N
Species of MetaboliteComponentSourceComments
Lobaria kurokawae (ncbitaxon:376185) - PubMed (19479840)
ChEBI Ontology
Outgoing Relation(s)
Lobarialide B (CHEBI:208386) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(1R,5S,6R,9R,10R,13R,14R,17R,18S,21R,22R)-5,10,13,18-tetramethyl-9-propan-2-yl-20,23-dioxaheptacyclo[19.3.1.01,17.02,14.05,13.06,10.018,22]pentacos-2-ene-19,24-dione