CHEBI:70452 - Yungensin G

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Yungensin G
ChEBI ID CHEBI:70452
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 C46H56O12
Net Charge 0
Average Mass 800.92960
Monoisotopic Mass 800.37718
InChI InChI=1S/C46H56O12/c1-10-13-31(48)34-38(52)28(21-27-36(50)26-18-19-45(7,8)58-42(26)35(40(27)54)32(49)14-11-2)37(51)29(39(34)53)22-30-41(55)33(25(6)47)44(57)46(9,43(30)56)20-17-24(5)16-12-15-23(3)4/h15,17-19,50-54,56-57H,10-14,16,20-22H2,1-9H3/b24-17+
InChIKey DCPXDAYXKKMUTO-JJIBRWJFSA-N
SMILES CCCC(=O)c1c(O)c(Cc2c(O)c3C=CC(C)(C)Oc3c(C(=O)CCC)c2O)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 root (BTO:0001188). Et2O extract of air-dried and ground scaly rhizomes and roots See: PubMed
Elaphoglossum yungense (NCBI:txid551654) Found in rhizome (BTO:0001181). 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 G (CHEBI:70452) has role metabolite (CHEBI:25212)
Yungensin G (CHEBI:70452) is a 1-benzopyran (CHEBI:38443)
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:carboxylic ester(CHEBI:33308); HFP:phloroglucinol(CHEBI:16204); ISA:monoterpenoid(CHEBI:25409); ISA:acetophenones(CHEBI:22187); ISA:aromatic ketone(CHEBI:76224); ISA:resorcinols(CHEBI:33572); ISA:carbonyl compound(CHEBI:36586); ISA:aromatic ether(CHEBI:35618); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:enol(CHEBI:33823); ISA:polyol(CHEBI:26191); ISA:cyclic ketone(CHEBI:3992); ISA:organonitrogen compound(CHEBI:35352); ISA:aromatic alcohol(CHEBI:33854);