This website is for informational and educational purposes only. Please do not self-medicate; contact a medical professional for advice before administration. This website is for informational and educational purposes only. Please do not self-medicate; contact a medical professional for advice before administration.

Glabridin

PubChem CID: 124052

Connections displayed (default: 10).
Loading graph...

ℹ️ Click here to know more about the properties
Compound Synonyms Glabridin, 59870-68-7, UNII-HOC5567T41, 4-[(3R)-8,8-dimethyl-3,4-dihydro-2H-pyrano[2,3-f]chromen-3-yl]benzene-1,3-diol, CHEBI:5369, HOC5567T41, 4-(3,4-Dihydro-8,8-dimethyl-2H,8H-benzo(1,2-b:3,4-b')dipyran-3-yl)-1,3-benzenediol, MFCD03427694, DTXSID00208589, 1,3-Benzenediol, 4-(3,4-dihydro-8,8-dimethyl-2H,8H-benzo(1,2-b:3,4-b')dipyran-3-yl)-, (R)-, 1,3-Benzenediol,4-(3,4-dihydro-8,8-dimethyl-2H,8H-benzo[1,2-b:3,4-b']dipyran-3-yl)-,(R)-, (R)-4-(8,8-dimethyl-2,3,4,8-tetrahydropyrano[2,3-f]chromen-3-yl)benzene-1,3-diol, 4-[(3R)-3,4-Dihydro-8,8-dimethyl-2H,8H-benzo[1,2-b:3,4-b']dipyran-3-yl]-1,3-benzenediol, (R)-Glabridin, (R)-4-(8,8-dimethyl-3,4-dihydro-2H,8H-pyrano[2,3-f]chromen-3-yl)benzene-1,3-diol, 4-[(3R)-8,8-DIMETHYL-2H,3H,4H,8H-PYRANO[2,3-F]CHROMEN-3-YL]BENZENE-1,3-DIOL, 4-[(3R)-8,8-dimethyl-3,4-dihydro-2H,8H-pyrano[2,3-f]chromen-3-yl]benzene-1,3-diol, (R)-4-(3,4-Dihydro-8,8-dimethyl-2H,8H-benzo(1,2-b:3,4-b')dipyran-3-yl)-1,3-benzenediol, (R)-4-(3,4-Dihydro-8,8-dimethyl-2H,8H-benzo[1,2-b:3,4-b']dipyran-3-yl)-1,3-benzenediol, 1,3-BENZENEDIOL, 4-((3R)-3,4-DIHYDRO-8,8-DIMETHYL-2H,8H-BENZO(1,2-B:3,4-B')DIPYRAN-3-YL)-, 1,3-Benzenediol, 4-[(3R)-3,4-dihydro-8,8-dimethyl-2H,8H-benzo[1,2-b:3,4-b']dipyran-3-yl]-, 1,3-Benzenediol, 4-[(3R)-3,4-dihydro-8,8-dimethyl-2H,8H-benzo[1,2-b:3,4-b']dipyran-3-yl]-, 1,3-Benzenediol, 4-(3,4-dihydro-8,8-dimethyl-2H,8H-benzo[1,2-b:3,4-b']dipyran-3-yl)-, (R)-, 2H,8H-Benzo[1,2-b:3,4-b']dipyran, 1,3-benzenediol deriv., 4-[(3R)-3,4-Dihydro-8,8-dimethyl-2H,8H-benzo[1,2-b:3,4-b']dipyran-3-yl]-1,3-benzenediol, Glabridin, 4-((3R)-8,8-dimethyl-3,4-dihydro-2H,8H-benzo(1,2-b:3,4-b')dipyran-3-yl)benzene-1,3-diol, 4-[(3R)-8,8-dimethyl-3,4-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-3-yl]benzene-1,3-diol, Glabridin (Standard), GLABRIDIN [WHO-DD], MLS000697609, BIDD:ER0172, Glabridin, analytical standard, SCHEMBL114869, Glabridin - Bio-X trade mark, CHEMBL480477, HY-N0393R, DTXCID00131080, LBQIJVLKGVZRIW-ZDUSSCGKSA-N, GLXC-03194, HMS2271G14, HMS3885M04, HY-N0393, BDBM50441626, LMPK12080012, s3786, STL566095, AKOS015903270, Glabridin, >=98% (HPLC), powder, CCG-223443, FG41835, NCGC00247524-01, NCGC00247524-06, 1ST40257, AC-31452, AS-74264, BG300083, SMR000470944, CS-0008929, NS00034259, Q2386110, 4-[(3R)-8,8-dimethyl-3,4-dihydro-2H-pyrano[2,3-f]chromen- 3-yl]benzene-1,3-diol, 4-((R)-8,8-Dimethyl-3,4-dihydro-2H,8H-benzo[1,2-b:4,3-b']dipyran-3-yl)-benzene-1,3-diol, 4-[(3R)-3,4-Dihydro-8,8-dimethyl-2H,8H-benzo[1,2-b:3,4-b?]dipyran-3-yl]-1,3-benzenediol
Ghose Rule True
Classyfire Kingdom Organic compounds
Topological Polar Surface Area 58.9
Hydrogen Bond Donor Count 2.0
Pfizer 3 75 Rule False
Scaffold Graph Level C1CCC(C2CCC3C(CCC4CCCCC43)C2)CC1
Np Classifier Class Isoflavanones
Deep Smiles Occcccc6)O))[C@@H]COccC6)cccc6C=CCO6)C)C
Heavy Atom Count 24.0
Classyfire Class Isoflavonoids
Scaffold Graph Node Level C1CCC(C2COC3C(CCC4OCCCC43)C2)CC1
Classyfire Subclass Pyranoisoflavonoids
Isotope Atom Count 0.0
Molecular Complexity 488.0
Database Name cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count 1.0
Uniprot Id O75164, Q16236, Q8IL88, P84022, P08684, P20813, O75496, P43220, P38398, Q9NUW8, Q13148, P37840, P27169, P18031, P02766, n.a., P14679, P04798, Q16678, P0DTD1
Iupac Name 4-[(3R)-8,8-dimethyl-3,4-dihydro-2H-pyrano[2,3-f]chromen-3-yl]benzene-1,3-diol
Prediction Hob 1.0
Veber Rule True
Classyfire Superclass Phenylpropanoids and polyketides
Target Id NPT109, NPT178, NPT77, NPT741
Xlogp 3.9
Gsk 4 400 Rule False
Molecular Formula C20H20O4
Scaffold Graph Node Bond Level C1=Cc2c(ccc3c2OCC(c2ccccc2)C3)OC1
Prediction Swissadme 1.0
Inchi Key LBQIJVLKGVZRIW-ZDUSSCGKSA-N
Silicos It Class Moderately soluble
Fcsp3 0.3
Logs -3.403
Rotatable Bond Count 1.0
Logd 4.037
Synonyms glabridin
Esol Class Moderately soluble
Functional Groups cC=CC, cO, cOC
Compound Name Glabridin
Prediction Hob Swissadme 1.0
Exact Mass 324.136
Formal Charge 0.0
Monoisotopic Mass 324.136
Hydrogen Bond Acceptor Count 4.0
Molecular Weight 324.4
Gi Absorption True
Covalent Unit Count 1.0
Total Atom Stereocenter Count 1.0
Total Bond Stereocenter Count 0.0
Lipinski Rule Of 5 True
Esol -4.6058312
Inchi InChI=1S/C20H20O4/c1-20(2)8-7-16-18(24-20)6-3-12-9-13(11-23-19(12)16)15-5-4-14(21)10-17(15)22/h3-8,10,13,21-22H,9,11H2,1-2H3/t13-/m0/s1
Smiles CC1(C=CC2=C(O1)C=CC3=C2OC[C@H](C3)C4=C(C=C(C=C4)O)O)C
Nring 4.0
Np Classifier Biosynthetic Pathway Shikimates and Phenylpropanoids
Defined Bond Stereocenter Count 0.0
Egan Rule True
Np Classifier Superclass Isoflavonoids

  • 1. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Glabra (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 2. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Inflata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 3. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Uralensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 4. Outgoing r'ship FOUND_IN to/from Mitracarpus Scaber (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 5. Outgoing r'ship FOUND_IN to/from Sophora Flavescens (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
Back to Browse   Back to Home