CHEBI:167691 - chermesin D methyl ester

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ChEBI Name chermesin D methyl ester
ChEBI ID CHEBI:167691
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C26H36O5
Net Charge 0
Average Mass 428.569
Monoisotopic Mass 428.25627
InChI InChI=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
InChIKey WZDKBDIIRCLIKU-MNKLQMRISA-N
SMILES [C@@]12([C@](CC[C@@H]([C@]13OC=4[C@](C3)(C(=C(C(C4C)=O)C(=O)OC)C)C)C)([H])C(C(CC2)=O)(C)C)C
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via meroterpenoid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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)
Synonym Source
chermesin D methyl ester UniProt
Citation Waiting for Citations Type Source
29968715 PubMed citation SUBMITTER