CHEBI:9020 - Sanggenon C

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ChEBI Name Sanggenon C
ChEBI ID CHEBI:9020
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C40H36O12
Net Charge 0
Average Mass 708.708
Monoisotopic Mass 708.22068
InChI InChI=1S/C40H36O12/c1-18(2)10-11-39-27-9-6-22(43)16-31(27)52-40(39,50)38(49)35-32(51-39)17-30(46)34(37(35)48)26-13-19(3)12-25(23-7-4-20(41)14-28(23)44)33(26)36(47)24-8-5-21(42)15-29(24)45/h4-10,13-17,25-26,33,41-46,48,50H,11-12H2,1-3H3/t25-,26+,33-,39?,40?/m1/s1
InChIKey XETHJOZXBVWLLM-QAHMVTMMSA-N
SMILES CC(C)=CCC12Oc3cc(O)c([C@H]4C=C(C)C[C@@H]([C@H]4C(=O)c4ccc(O)cc4O)c4ccc(O)cc4O)c(O)c3C(=O)C1(O)Oc1cc(O)ccc21
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 Sanggenon C (CHEBI:9020) is a diarylheptanoid (CHEBI:78802)
Synonym Source
Sanggenon C KEGG COMPOUND
Manual Xrefs Databases
C00001000 KNApSAcK
C09834 KEGG COMPOUND
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Registry Number Type Source
80651-76-9 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014