CHEBI:5511 - Gnetin A

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ChEBI Name Gnetin A
ChEBI ID CHEBI:5511
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C28H22O6
Net Charge 0
Average Mass 454.472
Monoisotopic Mass 454.14164
InChI InChI=1S/C28H22O6/c29-19-7-2-15(3-8-19)1-4-17-13-23(33)27-24(16-5-9-20(30)10-6-16)25(26(17)28(27)34)18-11-21(31)14-22(32)12-18/h1-14,24-27,29-32H/b4-1+/t24-,25-,26+,27-/m1/s1
InChIKey SVSWTEAHRCVGAR-XJAAUWFPSA-N
SMILES Oc1ccc(\C=C\C2=CC(=O)[C@@H]3[C@@H]([C@H]([C@H]2C3=O)c2cc(O)cc(O)c2)c2ccc(O)cc2)cc1
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via diarylheptanoid )
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ChEBI Ontology
Outgoing Gnetin A (CHEBI:5511) is a diarylheptanoid (CHEBI:78802)
Synonym Source
Gnetin A KEGG COMPOUND
Manual Xrefs Databases
C00002883 KNApSAcK
C10260 KEGG COMPOUND
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Registry Number Type Source
82084-87-5 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014