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CHEBI:167691 - chermesin D methyl ester

ChEBI IDCHEBI:167691
ChEBI Namechermesin D methyl ester
Stars
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC26H36O5
Net Charge0
Average Mass428.569
Monoisotopic Mass428.25627
SMILES[H][C@@]12CC[C@H](C)[C@@]3(C[C@]4(C)C(C)=C(C(=O)OC)C(=O)C(C)=C4O3)[C@@]1(C)CCC(=O)C2(C)C
InChIInChI=1S/C26H36O5/c1-14-9-10-17-23(4,5)18(27)11-12-25(17,7)26(14)13-24(6)16(3)19(22(29)30-8)20(28)15(2)21(24)31-26/h14,17H,9-13H2,1-8H3/t14-,17-,24+,25-,26-/m0/s1
InChIKeyWZDKBDIIRCLIKU-MNKLQMRISA-N
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)
chermesin D methyl ester (CHEBI:167691) is a cyclic ketone (CHEBI:3992)
chermesin D methyl ester (CHEBI:167691) is a meroterpenoid (CHEBI:64419)
chermesin D methyl ester (CHEBI:167691) is a methyl ester (CHEBI:25248)
chermesin D methyl ester (CHEBI:167691) is a organic heterotetracyclic compound (CHEBI:38163)
UniProt Name  Source
chermesin D methyl esterUniProt
Citations