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CHEBI:69780 - chlorajaponilide D

Default Structure
ChEBI IDCHEBI:69780
ChEBI Namechlorajaponilide D
Stars
DefinitionA natural product found in Chloranthus japonicus.
Last Modified22 September 2014
DownloadsMolfile
FormulaC40H42O14
Net Charge0
Average Mass746.762
Monoisotopic Mass746.25746
SMILES[H][C@@]12C[C@]1([H])[C@@]1(O)C[C@]3([H])[C@]4(OC(=O)C5=C4C[C@@]4([H])[C@](O)(COC(=O)/C(C)=C/COC(=O)CCC(=O)OC5)[C@@]5([H])C[C@@]5([H])[C@@]43C)C3=C1[C@@]2(C)C(=O)[C@@]1(OC)OC(=O)C(C)=C31
InChIInChI=1S/C40H42O14/c1-16-8-9-50-26(41)6-7-27(42)51-14-18-19-12-24-35(3,20-10-23(20)38(24,48)15-52-31(16)43)25-13-37(47)22-11-21(22)36(4)30(37)29(39(19,25)53-33(18)45)28-17(2)32(44)54-40(28,49-5)34(36)46/h8,20-25,47-48H,6-7,9-15H2,1-5H3/b16-8+/t20-,21-,22+,23+,24-,25+,35+,36+,37+,38+,39+,40+/m1/s1
InChIKeyZXVHWWCHBUYLGD-AGMOAELYSA-N
Species of MetaboliteComponentSourceComments
Chloranthus japonicus (ncbitaxon:13007) whole plant (BTO:0001461) PubMed (21650224) Methanolic extract of dried and powdered plant
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
chlorajaponilide D (CHEBI:69780) has role metabolite (CHEBI:25212)
chlorajaponilide D (CHEBI:69780) is a triterpenoid (CHEBI:36615)
Citations