Compound Description

ID:   C0403 Common name:   Silibinin
IUPAC:  3,5,7-trihydroxy-2-[3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydrochromen-4-one CAS:  CAS:22888-70-6
Chembl ID:   CHEMBL1401508 Pubchem ID:   CID:5213
Formula:  C25H22O10 TCM-ID:  TCMC2079
Smiles:  OCC1Oc2ccc(cc2OC1c1ccc(c(c1)OC)O)C1Oc2cc(O)cc(c2C(=O)C1O)O
Alias:

4-Chromanone, 3,5,7-trihydroxy-2-[3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-1,4-benzodioxan-6-yl]-;

4H-1-Benzopyran-4-one, 2-[2,3-dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-, [2R-[2α,3β,6(2R*,3R*)]]-;

Silybin;

(2R,3R)-2-[(2R,3R)-2,3-Dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one;

1,4-Benzodioxin, 4H-1-benzopyran-4-one deriv.;

7C3MT;

Mepasil;

Realsil;

Silibinin;

Silibinin A;

Silliver;

Silybin A;

Silybin b1;

Silybine;

Silybum substance E6;

Silymarin I;

Silymarin MZ 80;

Silymarine I
Structure:

Related Targets  (Total: 20)

Target idProtein NameGene SymbolUniprot IDTarget LevelNo.of Literature Evidence
T96OOK Signal transducer and activator of transcription 3STAT3 P40763
A 2 Reference(s)
T05O6O Estrogen receptor betaESR2 Q92731
A 2 Reference(s)
T64X48 C-X-C chemokine receptor type 4CXCR4 P61073
A 2 Reference(s)
T47H3O Heat shock protein HSP 90-alphaHSP90AA1 P07900
A 1 Reference(s)
T09H2Z Nitric oxide synthase, inducibleNOS2 P35228
A 2 Reference(s)
T88TDZ RAC-alpha serine/threonine-protein kinaseAKT1 P31749
A 1 Reference(s)
T27LA6 DNADNMT1 P26358
A 1 Reference(s)
T49ORJ Peroxisome proliferator-activated receptor alphaPPARA Q07869
C 1 Reference(s)
T43SM9 Peroxisome proliferator-activated receptor gamma coactivator 1-alphaPPARGC1A Q9UBK2
C 1 Reference(s)
T02Z3O Low-density lipoprotein receptor-related protein 6LRP6 O75581
C 1 Reference(s)
T10H9X UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunitOGT O15294
C 1 Reference(s)
T82JWE Cellular tumor antigen p53TP53 P04637
C 1 Reference(s)
T43N2D Epidermal growth factor receptorEGFR P00533
C 1 Reference(s)
T08Q7W Prostaglandin G/H synthase 2PTGS2 P35354
C 1 Reference(s)
T87F4H Insulin-induced gene 1 proteinINSIG1 O15503
C 1 Reference(s)
T40JZG GPI-anchor transamidasePIGK Q92643
C 1 Reference(s)
T93SFQ NAD-dependent protein deacetylase sirtuin-1SIRT1 Q96EB6
C 1 Reference(s)
T33OSQ Sterol regulatory element-binding protein 1SREBF1 P36956
C 1 Reference(s)
T68M1D Histone deacetylase 2HDAC2 Q92769
C 1 Reference(s)
T57HGP Tumor necrosis factor receptor superfamily member 6FAS P25445
C 1 Reference(s)

*In this table, target level represents the quality confidence indicators of targets.
Level 'A' represents "Directly inhibit/activate".
Level 'B' represents "Indirectly inhibit/ activate", "Enzyme substate" and "Enzyme product".
Level 'C' represents "Up/Down regulation" and "Others".

Related Herbs  (Total: 3)

Herb idChinese Pin YinChinese CharacterEnglish NameLatin Name
H0095 Gou Qi Zi枸杞子 Chinese wolfberry fruitLycium chinense
H0094 Gou Qi枸杞 Chinese wolfberry fruitLycium chinense
H0484 Shui Fei Ji水飞蓟 St marysSilybum marianum