Compound Summary
Compound Information
puerarin
Compound Name: | puerarin |
Compound CID: | 5281807 |
Synonyms: | Puerarin 3681-99-0 Kakonein Daidzein-8-C-glucoside 7-hydroxy-3-(4-hydroxyphenyl)-8-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-4H-chromen-4-one More... |
Iupac Name: | 7-hydroxy-3-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one |
InChI: | InChI=1S/C21H20O9/c22-7-14-17(26)18(27)19(28)21(30-14)15-13(24)6-5-11-16(25)12(8-29-20(11)15)9-1-3-10(23)4-2-9/h1-6,8,14,17-19,21-24,26-28H,7H2/t14-,17-,18+,19-,21+/m1/s1 |
InChIKey: | HKEAFJYKMMKDOR-VPRICQMDSA-N |
Canonical Smiles: | C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3C4C(C(C(C(O4)CO)O)O)O)O)O |
Isomeric Smiles: | C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O |
Molecular Weight: | 416.4 |
Molecular Formula: | C21H20O9 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
puerarin
Molecular Weight: | 416.4 |
Molecular Formula: | C21H20O9 |
Hydrogen Bond Donor Count: | 6 |
Hydrogen Bond Acceptor Count: | 9 |
Rotatable Bond Count: | 3 |
Heavy Atom Count: | 30 |
Complexity: | 659 |
Synonyms
puerarin
| puerarin | puerarin |
|---|---|
Puerarin |
3681-99-0 |
Kakonein |
Daidzein-8-C-glucoside |
7-hydroxy-3-(4-hydroxyphenyl)-8-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-4H-chromen-4-one |
Puerarin 80 mm |
CHEBI:8633 |
NPI 031G |
Daidzein 8-c-glucoside |
NSC-380711 |
7-hydroxy-3-(4-hydroxyphenyl)-8-(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-ylchromen-4-one |
Z9W8997416 |
Puerarin, analytical standard |
MFCD00063399 |
AC1NQZ4N |
8-C-glucoside |
8-Glucosyldaidzein |
UNII-Z9W8997416 |
NSC 380711 |
7,4-Dihydroxy-8-C-glucosylisoflavone |
BRN 0064198 |
8-Glucopyranosyldaidzein |
PUERARIN INCI |
PUERARIN WHO-DD |
SureCN8581666 |
4-19-00-03200 (Beilstein Handbook Reference) |
MLS002473178 |
BIDD:ER0101 |
CHEMBL486386 |
SCHEMBL8581666 |
HKEAFJYKMMKDOR-VPRICQMDSA- |
DTXSID30958020 |
HMS2198M10 |
Puerarin, >=98.0% (HPLC) |
HY-N0145 |
ZINC4098745 |
BDBM50129558 |
8-beta-D-Glucopyranosyl-7-hydroxy-3-(4-hydroxyphenyl)-4H-1-benzopyran-4-one |
AKOS007930376 |
AKOS015965556 |
CS-6158 |
DB12290 |
KS-5191 |
4H-1-Benzopyran-4-one, 8-beta-D-glucopyranosyl-7-hydroxy-3-(4-hydroxyphenyl)- |
7-hydroxy-3-(4-hydroxyphenyl)-8-(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-ylchromen-4-one |
AC-20294 |
SMR001397270 |
4,7-DIHYDROXY-8-C-GLUCOSYLISOFLAVONE |
Q63408673 |
Z1494829516 |
(1S)-1,5-Anhydro-1-7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl-D-glucitol |
4H-1-BENZOPYRAN-4-ONE, 8-.BETA.-D-GLUCOPYRANOSYL-7-HYDROXY-3-(4-HYDROXYPHENYL)- |
8-(-bet.-D-Glucopyranosyl-7-hydroxy-3- (4-hydroxyphenyl)-4H-1-benzopyran-4-one |
8-(beta-D-Glucopyranosyl-7-hydroxy-3- (4-hydroxyphenyl)-4H-1-benzopyran-4-one |
(1S)-1,5-anhydro-1-7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-8-yl-D-glucitol |
7-hydroxy-3-(4-hydroxyphenyl)-8-(3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-ylchromen-4-one |
Experimental Data
puerarin
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Drosophila melanogaster | 60 | umol/L | 0 | S | Canton-S | FEMALES | 36752212 | Active | |||||
| Drosophila melanogaster | 120 | umol/L | 0 | S | w1118 | FEMALES | 36752212 | Active | |||||
| Drosophila melanogaster | 120 | umol/L | 0 | S | w1118 | MALES | 36752212 | Active | |||||
| Drosophila melanogaster | 60 | umol/L | 0 | S | Canton-S | MALES | 36752212 | Active | |||||
| Drosophila melanogaster | 120 | umol/L | 0 | S | Canton-S | MALES | 36752212 | Active | |||||
| Drosophila melanogaster | 120 | umol/L | 0 | S | Canton-S | FEMALES | 36752212 | Active | |||||
| Drosophila melanogaster | 60 | umol/L | 0 | S | w1118 | FEMALES | 36752212 | Active | |||||
| Drosophila melanogaster | 60 | umol/L | 0 | S | w1118 | MALES | 36752212 | Active |
Experimental Data Visualization
puerarin
Statistics Data
puerarin
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Drosophila melanogaster | 0 | 1 | 8 |
Statistics Data Visualization
puerarin
