CHEBI:228889 - Myrislignan

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Myrislignan
ChEBI ID CHEBI:228889
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H26O6
Net Charge 0
Average Mass 374.433
Monoisotopic Mass 374.17294
InChI InChI=1S/C21H26O6/c1-6-7-14-10-18(25-4)21(19(11-14)26-5)27-13(2)20(23)15-8-9-16(22)17(12-15)24-3/h6,8-13,20,22-23H,1,7H2,2-5H3/t13-,20-/m0/s1
InChIKey ULZFTGWWPHYLGI-RBZFPXEDSA-N
SMILES O([C@H]([C@H](O)C1=CC(OC)=C(O)C=C1)C)C2=C(OC)C=C(C=C2OC)CC=C
Metabolite of Species Details
Zea mays (NCBI:txid4577) Found in exometabolome See: MetaboLights Study
ChEBI Ontology
Outgoing Myrislignan (CHEBI:228889) is a phenylpropanoid (CHEBI:26004)
IUPAC Name
4-[(1R,2S)-2-(2,6-dimethoxy-4-prop-2-enylphenoxy)-1-hydroxypropyl]-2-methoxyphenol
Manual Xref Database
10270348 ChemSpider
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