CHEBI:8234 - Piperaduncin B

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ChEBI Name Piperaduncin B
ChEBI ID CHEBI:8234
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C29H30O8
Net Charge 0
Average Mass 506.545
Monoisotopic Mass 506.19407
InChI InChI=1S/C29H30O8/c1-29(2,34)27-23(18-14-17(28(33)36-4)11-13-19(18)30)25-22(35-3)15-21(32)24(26(25)37-27)20(31)12-10-16-8-6-5-7-9-16/h5-9,11,13-15,23,27,30,32,34H,10,12H2,1-4H3/t23-,27-/m0/s1
InChIKey KGNWKZGVYSTAOX-HOFKKMOUSA-N
SMILES COC(=O)c1ccc(O)c(c1)[C@@H]1[C@H](Oc2c1c(OC)cc(O)c2C(=O)CCc1ccccc1)C(C)(C)O
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 Piperaduncin B (CHEBI:8234) is a diarylheptanoid (CHEBI:78802)
Synonym Source
Piperaduncin B KEGG COMPOUND
Manual Xrefs Databases
C00000994 KNApSAcK
C09829 KEGG COMPOUND
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Registry Number Type Source
155023-55-5 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014