CHEBI:69978 - Agatharesinol acetonide

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ChEBI Name Agatharesinol acetonide
ChEBI ID CHEBI:69978
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 C20H22O4
Net Charge 0
Average Mass 326.38630
Monoisotopic Mass 326.15181
InChI InChI=1S/C20H22O4/c1-20(2)23-13-19(24-20)18(15-6-10-17(22)11-7-15)12-5-14-3-8-16(21)9-4-14/h3-12,18-19,21-22H,13H2,1-2H3/b12-5+/t18-,19+/m0/s1
InChIKey DGNCNVJVRJKHEP-ORFBMEDESA-N
SMILES [H][C@@]1(COC(C)(C)O1)[C@@H](\C=C\c1ccc(O)cc1)c1ccc(O)cc1
Metabolite of Species Details
Metasequoia glyptostroboides (NCBI:txid3371) Found in stem (BTO:0001300). 95% ethanolic extract of air-dried, powdered stems and leaves See: PubMed
Metasequoia glyptostroboides (NCBI:txid3371) Found in leaf (BTO:0000713). 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 Agatharesinol acetonide (CHEBI:69978) has role metabolite (CHEBI:25212)
Agatharesinol acetonide (CHEBI:69978) is a phenols (CHEBI:33853)
Citation Waiting for Citations Type Source
21226514 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:styrenes(CHEBI:26799); ISA:phenols(CHEBI:33853); ISA:dioxolane(CHEBI:39430); ISA:polyol(CHEBI:26191); ISA:acetal(CHEBI:59769); ISA:aromatic alcohol(CHEBI:33854);