CHEBI:53644 - sequirin C

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ChEBI Name sequirin C
ChEBI ID CHEBI:53644
Definition A norlignan that is a derivative of agatharesinol in which the aromatic ring B has an additional hydroxy substituent ortho to the one present in the parent compound.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C17H18O5
Net Charge 0
Average Mass 302.32180
Monoisotopic Mass 302.11542
InChI InChI=1S/C17H18O5/c18-10-17(22)14(12-4-8-15(20)16(21)9-12)7-3-11-1-5-13(19)6-2-11/h1-9,14,17-22H,10H2/b7-3+/t14-,17+/m0/s1
InChIKey UWWISKPOVFKUES-SITIDLGXSA-N
SMILES OC[C@@H](O)[C@@H](\C=C\c1ccc(O)cc1)c1ccc(O)c(O)c1
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.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via norlignan )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing sequirin C (CHEBI:53644) has functional parent agatharesinol (CHEBI:53627)
sequirin C (CHEBI:53644) has role metabolite (CHEBI:25212)
sequirin C (CHEBI:53644) is a norlignan (CHEBI:53629)
IUPAC Name
4-[(1S,2E)-1-[(1S)-1,2-dihydroxyethyl]-3-(4-hydroxyphenyl)prop-2-en-1-yl]benzene-1,2-diol
Synonym Source
sequirin-C ChEBI
Registry Numbers Types Sources
7354895 Beilstein Registry Number Beilstein
7354895 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
11371016 PubMed citation Europe PMC
11684179 PubMed citation Europe PMC
15124091 PubMed citation Europe PMC
IND43826632 Agricola citation Europe PMC
Last Modified
06 August 2013