Compound Summary
Compound Information
(+)-Catechin Hydrate
Compound Name: | (+)-Catechin Hydrate |
Compound CID: | 107957 |
Synonyms: | (+)-Catechin Hydrate Catechin hydrate 225937-10-0 (+)-catechin monohydrate (2R,3S)-2-(3,4-Dihydroxyphenyl)chroman-3,5,7-triol hydrate More... |
Iupac Name: | (2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol;hydrate |
InChI: | InChI=1S/C15H14O6.H2O/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7;/h1-5,13,15-20H,6H2;1H2/t13-,15+;/m0./s1 |
InChIKey: | OFUMQWOJBVNKLR-NQQJLSKUSA-N |
Canonical Smiles: | C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O.O |
Isomeric Smiles: | C1[C@@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O.O |
Molecular Weight: | 308.28 |
Molecular Formula: | C15H16O7 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
(+)-Catechin Hydrate
Molecular Weight: | 308.28 |
Molecular Formula: | C15H16O7 |
Hydrogen Bond Donor Count: | 6 |
Hydrogen Bond Acceptor Count: | 7 |
Rotatable Bond Count: | 1 |
Heavy Atom Count: | 22 |
Complexity: | 364 |
Synonyms
(+)-Catechin Hydrate
| (+)-Catechin Hydrate | (+)-Catechin Hydrate |
|---|---|
(+)-Catechin Hydrate |
Catechin hydrate |
225937-10-0 |
(+)-catechin monohydrate |
(2R,3S)-2-(3,4-Dihydroxyphenyl)chroman-3,5,7-triol hydrate |
88191-48-4 |
(+)-Cyanidol-3 |
CHEBI:58994 |
MFCD00149354 |
(2R-trans)-2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol monohydrate |
(2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol;hydrate |
D-Catechin hydrate |
MLS001056745 |
(2R,3S)-2-(3,4-dihydroxyphenyl)chromane-3,5,7-triol--water (1/1) |
SMR000326724 |
MFCD00150865 |
(2R,3S)-2-(3,4-Dihydroxyphenyl)-3,4-dihydro-1(2H)-benzopyran-3,5,7-triol |
Cianidanol (JAN/INN) |
(+)-Catechin hydrate(1:x) |
SCHEMBL133974 |
CHEMBL1256783 |
DTXSID801007988 |
HMS2233I24 |
HMS3649E10 |
AKOS016843747 |
trans-2-(3,4-Dihydroxyphenyl)-3,4-dihydro-1(2H)-benzopyran-3,5,7-triol |
DS-2787 |
2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol monohydrate, (2R-trans)- |
2H-1-Benzopyran-3,5,7-triol, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-, monohydrate, (2R-trans)- |
trans-3,3,4,5,7-Pentahydroxyflavane |
AB0109372 |
D00200 |
S00276 |
(+)-Catechin hydrate, >=98% (HPLC), powder |
295C854 |
W-104471 |
(+/-)-Catechin hydrate, purum, >=96.0% (HPLC) |
Q27126384 |
SR-01000075742-11 |
SR-01000075742-15 |
(+)-Catechin hydrate, >=96.0% (sum of enantiomers, HPLC) |
(+/-)-Catechin hydrate, primary pharmaceutical reference standard |
(2R,3S)-2-(3,4-Dihydroxyphenyl)-chroman-3,5,7-triol hydrate |
(2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol hydrate |
2H-1-Benzopyran-3,5,7-triol, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-, monohydrate, (2R,3S)- |
Experimental Data
(+)-Catechin Hydrate
| 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 | 8 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
(+)-Catechin Hydrate
Statistics Data
(+)-Catechin Hydrate
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 8 | 1 | 1 |
Statistics Data Visualization
(+)-Catechin Hydrate
