loading...| Preferred Name |
silibinin |
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| Synonyms |
silibininum Silibinine (2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydro-4H-chromen-4-one silibinine Silymarin silibinin Silibinin Karsil Flavobin C25H22O10 silibinina |
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| ID |
http://purl.obolibrary.org/obo/CHEBI_9144 |
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| Definition |
A flavonolignan isolated from milk thistle, Silybum marianum, that has been shown to exhibit antioxidant and antineoplastic activities. |
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| has role |
http://purl.obolibrary.org/obo/CHEBI_35610 http://purl.obolibrary.org/obo/CHEBI_26619 |
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| InChI |
InChI=1S/C25H22O10/c1-32-17-6-11(2-4-14(17)28)24-20(10-26)33-16-5-3-12(7-18(16)34-24)25-23(31)22(30)21-15(29)8-13(27)9-19(21)35-25/h2-9,20,23-29,31H,10H2,1H3/t20-,23+,24-,25-/m1/s1 |
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| InChIKey |
InChIKey=SEBFKMXJBCUCAI-HKTJVKLFSA-N |
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| label |
silibinin |
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| prefixIRI |
obo2:CHEBI_9144 |
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| prefLabel |
silibinin |
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| SMILES |
[H][C@@]1(Oc2cc(ccc2O[C@@H]1CO)[C@@]1([H])Oc2cc(O)cc(O)c2C(=O)[C@@H]1O)c1ccc(O)c(OC)c1 |
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| Synonym |
silibininum Silibinine (2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydro-4H-chromen-4-one silibinine Silymarin silibinin Silibinin Karsil Flavobin C25H22O10 silibinina |
|
| xref |
ChEMBL:147766 KEGG DRUG:D08515 CiteXplore:22899727 Patent:CN102727484 Reaxys:1632852 CASRN:22888-70-6 CiteXplore:23357565 Wikipedia:Silibinin CiteXplore:22086675 CiteXplore:22555054 KEGG COMPOUND:C07610 HMDB:HMDB30583 CiteXplore:23402882 CiteXplore:23073223 |
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| subClassOf |