CHEBI:70297 - Yungensin D

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ChEBI Name Yungensin D
ChEBI ID CHEBI:70297
Definition A natural product found in Elaphoglossum yungense.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C35H46O8
Net Charge 0
Average Mass 594.73490
Monoisotopic Mass 594.31927
InChI InChI=1S/C35H46O8/c1-9-11-26(37)28-30(39)23(15-14-20(4)5)29(38)24(31(28)40)18-25-32(41)27(22(7)36)34(43)35(8,33(25)42)17-16-21(6)13-10-12-19(2)3/h12,14,16,38-40,42-43H,9-11,13,15,17-18H2,1-8H3/b21-16+
InChIKey DPDVRLNGFWFYRI-LTGZKZEYSA-N
SMILES CCCC(=O)c1c(O)c(CC=C(C)C)c(O)c(CC2=C(O)C(C)(C\C=C(/C)CCC=C(C)C)C(O)=C(C(C)=O)C2=O)c1O
Metabolite of Species Details
Elaphoglossum yungense (NCBI:txid551654) Found in rhizome (BTO:0001181). Et2O extract of air-dried and ground scaly rhizomes and roots See: PubMed
Elaphoglossum yungense (NCBI:txid551654) Found in root (BTO:0001188). Et2O extract of air-dried and ground scaly rhizomes and roots See: PubMed
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Yungensin D (CHEBI:70297) has functional parent phloroglucinol (CHEBI:16204)
Yungensin D (CHEBI:70297) has role metabolite (CHEBI:25212)
Yungensin D (CHEBI:70297) is a carboxylic ester (CHEBI:33308)
Synonym Source
2-{[2,4,6-trihydroxy-5-(3-methyl-2-butenyl)-3-butanoylphenyl]methyl}-3,5-dihydroxy-4-methyl-4-(3,7-dimethyl-2,6-octadienyl)-6-acetyl-2,5-cyclohexadien-1-one ChEBI
Citation Waiting for Citations Type Source
21043474 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:butanone(CHEBI:22951); ISA:monoterpenoid(CHEBI:25409); ISA:acetophenones(CHEBI:22187); ISA:carbonyl compound(CHEBI:36586); ISA:aromatic ketone(CHEBI:76224); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:enol(CHEBI:33823); ISA:cyclic ketone(CHEBI:3992); ISA:polyol(CHEBI:26191); ISA:organic heterocyclic compound(CHEBI:24532); ISA:organonitrogen compound(CHEBI:35352); ISA:aromatic alcohol(CHEBI:33854);