Compound Summary
Compound Information
Proanthocyanidin
Compound Name: | Proanthocyanidin |
Compound CID: | 108065 |
Synonyms: | Proanthocyanidin 18206-61-6 Proanthocyanidin (grape seed extract) Ouratea proanthocyanidin A (3R)-2-(3,5-dihydroxy-4-methoxyphenyl)-8-(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl-3,4-dihydro-2H-chromene-3,5,7-triol More... |
Iupac Name: | (3R)-2-(3,5-dihydroxy-4-methoxyphenyl)-8-[(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol |
InChI: | InChI=1S/C31H28O12/c1-41-31-20(37)6-13(7-21(31)38)28-22(39)10-16-17(34)11-19(36)25(30(16)43-28)26-24-18(35)8-15(33)9-23(24)42-29(27(26)40)12-2-4-14(32)5-3-12/h2-9,11,22,26-29,32-40H,10H2,1H3/t22-,26-,27-,28?,29-/m1/s1 |
InChIKey: | JPFCOVZKLAXXOE-XBNSMERZSA-N |
Canonical Smiles: | COC1=C(C=C(C=C1O)C2C(CC3=C(O2)C(=C(C=C3O)O)C4C(C(OC5=CC(=CC(=C45)O)O)C6=CC=C(C=C6)O)O)O)O |
Isomeric Smiles: | COC1=C(C=C(C=C1O)C2[C@@H](CC3=C(O2)C(=C(C=C3O)O)[C@@H]4[C@H]([C@H](OC5=CC(=CC(=C45)O)O)C6=CC=C(C=C6)O)O)O)O |
Molecular Weight: | 592.5 |
Molecular Formula: | C31H28O12 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Proanthocyanidin
Molecular Weight: | 592.5 |
Molecular Formula: | C31H28O12 |
Hydrogen Bond Donor Count: | 9 |
Hydrogen Bond Acceptor Count: | 12 |
Rotatable Bond Count: | 4 |
Heavy Atom Count: | 43 |
Complexity: | 920 |
Synonyms
Proanthocyanidin
| Proanthocyanidin | Proanthocyanidin |
|---|---|
Proanthocyanidin |
18206-61-6 |
Proanthocyanidin (grape seed extract) |
Ouratea proanthocyanidin A |
(3R)-2-(3,5-dihydroxy-4-methoxyphenyl)-8-(2R,3R,4R)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl-3,4-dihydro-2H-chromene-3,5,7-triol |
Polyhydroxyflavan-3-ol |
274678-42-1 |
Zangrado |
CCRIS 9188 |
GRAPESEEDSEXTRACT |
SCHEMBL4747623 |
DTXSID00276046 |
AKOS015967674 |
(4,8-Bi-2H-1-benzopyran)-3,3,5,5,7,7-hexol, 2-(3,5-dihydroxy-4-methoxyphenyl)-3,3,4,4-tetrahydro-2-(4-hydroxyphenyl)-, (2R,2R,3R,3R,4R)-" |
(4,8-Bi-2H-1-benzopyran)-3,3,5,5,7,7-hexol, 2-(3,5-dihydroxy-4-methoxyphenyl)-3,3,4,4-tetrahydro-2-(4-hydroxyphenyl)-, (2R-(2alpha,3alpha,4beta(2R*,3R*)))- |
1884-EP2300450A1 |
J-011651 |
(2R,3R,4R)-4-(3R)-2-(3,5-dihydroxy-4-methoxyphenyl)-3,5,7-trihydroxychroman-8-yl-2-(4-hydroxyphenyl)chroman-3,5,7-triol |
2-(3,5-Dihydroxy-4-methoxyphenyl)-8-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-4-yl-3,4-dihydro-2H-chromene-3,5,7-triol |
Experimental Data
Proanthocyanidin
| 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 | 67 | ug/L | S | N2 | 33683565 |
Experimental Data Visualization
Proanthocyanidin
Statistics Data
Proanthocyanidin
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 1 | 1 |
Statistics Data Visualization
Proanthocyanidin
