CHEBI:174918 - Matricarin

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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 Matricarin
ChEBI ID CHEBI:174918
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H20O5
Net Charge 0
Average Mass 304.342
Monoisotopic Mass 304.13107
InChI InChI=1S/C17H20O5/c1-7-5-11(19)13-8(2)6-12(21-10(4)18)15-9(3)17(20)22-16(15)14(7)13/h5,9,12,14-16H,6H2,1-4H3/t9-,12-,14-,15+,16+/m0/s1
InChIKey QONYNSMAVSRIRD-UPQAZBFISA-N
SMILES O1[C@]2([C@]([C@@H](C1=O)C)([C@@H](OC(=O)C)CC(=C3[C@@]2(C(=CC3=O)C)[H])C)[H])[H]
ChEBI Ontology
Outgoing Matricarin (CHEBI:174918) is a γ-lactone (CHEBI:37581)
IUPAC Name
[(3S,3aR,4S,9aS,9bR)-3,6,9-trimethyl-2,7-dioxo-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]uran-4-yl] acetate
Manual Xref Database
2341062 ChemSpider
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Registry Number Type Source
5989-43-5 CAS Registry Number ChemIDplus