Compound Summary
Compound Information
Glyceollin
Compound Name: | Glyceollin |
Compound CID: | 162807 |
Synonyms: | Glyceollin glyceollin I (-)-Glyceollin I 57103-57-8 UNII-6461TV6UCH More... |
Iupac Name: | (2S,10S)-17,17-dimethyl-3,12,18-trioxapentacyclo[11.8.0.02,10.04,9.014,19]henicosa-1(13),4(9),5,7,14(19),15,20-heptaene-6,10-diol |
InChI: | InChI=1S/C20H18O5/c1-19(2)8-7-12-15(25-19)6-4-13-17(12)23-10-20(22)14-5-3-11(21)9-16(14)24-18(13)20/h3-9,18,21-22H,10H2,1-2H3/t18-,20+/m0/s1 |
InChIKey: | YIFYYPKWOQSCRI-AZUAARDMSA-N |
Canonical Smiles: | CC1(C=CC2=C(O1)C=CC3=C2OCC4(C3OC5=C4C=CC(=C5)O)O)C |
Isomeric Smiles: | CC1(C=CC2=C(O1)C=CC3=C2OC[C@@]4([C@H]3OC5=C4C=CC(=C5)O)O)C |
Molecular Weight: | 338.4 |
Molecular Formula: | C20H18O5 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Glyceollin
Molecular Weight: | 338.4 |
Molecular Formula: | C20H18O5 |
Hydrogen Bond Donor Count: | 2 |
Hydrogen Bond Acceptor Count: | 5 |
Rotatable Bond Count: | 0 |
Heavy Atom Count: | 25 |
Complexity: | 574 |
Synonyms
Glyceollin
| Glyceollin | Glyceollin |
|---|---|
Glyceollin |
glyceollin I |
(-)-Glyceollin I |
57103-57-8 |
UNII-6461TV6UCH |
6461TV6UCH |
CHEBI:16470 |
(2S,10S)-17,17-dimethyl-3,12,18-trioxapentacyclo11.8.0.02,10.04,9.014,19henicosa-1(13),4(9),5,7,14(19),15,20-heptaene-6,10-diol |
66241-09-6 |
(-) - glyceollin I |
Glyceollins |
Glyceolin |
(6aS,11aS)-2,2-dimethyl-2H,6H-1benzofuro3,2-cpyrano2,3-hchromene-6a,9(11aH)-diol |
C01701 |
SCHEMBL364885 |
CHEMBL1774987 |
DTXSID10205726 |
LMPK12070123 |
XG161768 |
Q5572526 |
UNII-Y43CLK47RO component YIFYYPKWOQSCRI-AZUAARDMSA-N |
2H,6H-Benzofuro(3,2-c)pyrano(2,3-h)(1)benzopyran-6a,9(11aH)-diol, 2,2-dimethyl- |
Experimental Data
Glyceollin
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Saccharomyces cerevisiae | 12.5 | nM | 40 | S | 24399048 | Active |
Experimental Data Visualization
Glyceollin
Statistics Data
Glyceollin
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Saccharomyces cerevisiae | 40 | 1 | 1 |
Statistics Data Visualization
Glyceollin
