CHEBI:69960 - Metaseglyptorin A

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ChEBI Name Metaseglyptorin A
ChEBI ID CHEBI:69960
Definition A natural product found in Metasequoia glyptostroboides.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C32H54O3
Net Charge 0
Average Mass 486.76940
Monoisotopic Mass 486.40730
InChI InChI=1S/C32H54O3/c1-9-23(21(2)3)11-10-22(4)24-14-16-30(8)26-13-12-25(28(5,6)35)31(17-15-27(33)34)20-32(26,31)19-18-29(24,30)7/h22-26,35H,2,9-20H2,1,3-8H3,(H,33,34)/t22-,23?,24-,25+,26+,29-,30+,31-,32+/m1/s1
InChIKey XKNFVOLVUYNREE-JEWLOWAJSA-N
SMILES [H][C@@]1(CC[C@@]2(C)[C@]3([H])CC[C@@H](C(C)(C)O)[C@@]4(CCC(O)=O)C[C@@]34CC[C@]12C)[C@H](C)CCC(CC)C(C)=C
Metabolite of Species Details
Metasequoia glyptostroboides (NCBI:txid3371) Found in leaf (BTO:0000713). 95% ethanolic extract of air-dried, powdered stems and leaves See: PubMed
Metasequoia glyptostroboides (NCBI:txid3371) Found in stem (BTO:0001300). 95% ethanolic extract of air-dried, powdered stems and leaves 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 Metaseglyptorin A (CHEBI:69960) has role metabolite (CHEBI:25212)
Metaseglyptorin A (CHEBI:69960) is a triterpenoid (CHEBI:36615)
Synonym Source
3,4-secocycloarta-4-hydroxy-24-ethyl-25-en-3-oic acid ChEBI
Citation Waiting for Citations Type Source
21226514 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:carbocyclic fatty acid(CHEBI:35744); ISA:tertiary alcohol(CHEBI:26878); ISA:monocarboxylic acid(CHEBI:25384); ISA:carboxylic acid(CHEBI:33575); ISA:organonitrogen compound(CHEBI:35352); ISA:carbonyl compound(CHEBI:36586);