Compound Summary
Compound Information
Quercetin dihydrate
Compound Name: | Quercetin dihydrate |
Compound CID: | 5284452 |
Synonyms: | Quercetin dihydrate 6151-25-3 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one dihydrate MFCD00149487 Quercetine dihydrate More... |
Iupac Name: | 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one;dihydrate |
InChI: | InChI=1S/C15H10O7.2H2O/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6;;/h1-5,16-19,21H;2*1H2 |
InChIKey: | GMGIWEZSKCNYSW-UHFFFAOYSA-N |
Canonical Smiles: | C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O.O.O |
Isomeric Smiles: | C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O.O.O |
Molecular Weight: | 338.27 |
Molecular Formula: | C15H14O9 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Quercetin dihydrate
Molecular Weight: | 338.27 |
Molecular Formula: | C15H14O9 |
Hydrogen Bond Donor Count: | 7 |
Hydrogen Bond Acceptor Count: | 9 |
Rotatable Bond Count: | 1 |
Heavy Atom Count: | 24 |
Complexity: | 488 |
Synonyms
Quercetin dihydrate
| Quercetin dihydrate | Quercetin dihydrate |
|---|---|
Quercetin dihydrate |
6151-25-3 |
2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one dihydrate |
MFCD00149487 |
Quercetine dihydrate |
Quercetin (dihydrate) |
UNII-53B03V78A6 |
3,3,4,5,7-Pentahydroxyflavone dihydrate |
Quercetin dihydrate (Sophoretin) |
Ericin |
53B03V78A6 |
NCGC00017056-01 |
CAS-6151-25-3 |
2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one;dihydrate |
DSSTox_CID_1219 |
2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one dihydrate |
DSSTox_RID_76018 |
DSSTox_GSID_21219 |
C15H14O9 |
Quercetin, Dihydrate |
CCRIS 3304 |
Quercetin,(S) |
Flavone, 3,3,4,5,7-pentahydroxy-, dihydrate |
Prestwick_541 |
ACMC-20a8z6 |
3,3′,4′,5,7-Pentahydroxyflavone |
SCHEMBL22103 |
BMK1-G2 |
CHEMBL1520590 |
DTXSID9021219 |
Quercetin dihydrate - Sophoretin |
3,4,5,7-tetrahydroxyflavonol |
HMS1569F15 |
HMS2096F15 |
HMS3403F09 |
HMS3656A09 |
HMS3884N13 |
BCP07318 |
HY-N0146 |
Tox21_110761 |
Tox21_201150 |
s2347 |
SBB058176 |
2-(3,4-dihydroxyphenyl)-3,5,7- |
AKOS004910448 |
Tox21_110761_1 |
trihydroxy-4H-chromen-4-one dihydrate |
CCG-208320 |
NCGC00015870-27 |
NCGC00258702-01 |
AS-13663 |
H655 |
SY061661 |
AB0013168 |
CS-0007880 |
FT-0601606 |
ST50309238 |
SW148203-5 |
J10072 |
A833274 |
Q27261093 |
F0001-1629 |
2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one, hydrate, hydrate |
2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one, oxamethane, oxamethane |
2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one Dihydrate (Quercetin Dihydrate) |
2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one dihydrate; 3,3′,4′,5,7-Pentahydroxyflavone dihydrate |
Experimental Data
Quercetin dihydrate
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 33 | umol/L | 0 | NS | N2 | 24134630 | Inactive | ||||||
| Drosophila melanogaster | 1 | mM | 23 | S | Oregon-R | 22363408 | Active |
Experimental Data Visualization
Quercetin dihydrate
Statistics Data
Quercetin dihydrate
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 0 | 1 | 1 | |
| Drosophila melanogaster | 23 | 1 | 1 |
Statistics Data Visualization
Quercetin dihydrate
