Compound Summary
Compound Information
Delphinidin 3-O-beta-D-sambubioside
Compound Name: | Delphinidin 3-O-beta-D-sambubioside |
Compound CID: | 10196837 |
Synonyms: | Delphinidin 3-O-beta-D-sambubioside Delphinidin 3-sambubioside CHEBI:74810 C20491 Q27144921 More... |
Iupac Name: | (2S,3R,4S,5R)-2-[(2S,3R,4S,5S,6R)-2-[5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)chromenylium-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxyoxane-3,4,5-triol |
InChI: | InChI=1S/C26H28O16/c27-6-17-20(35)21(36)24(42-25-22(37)19(34)14(32)7-38-25)26(41-17)40-16-5-10-11(29)3-9(28)4-15(10)39-23(16)8-1-12(30)18(33)13(31)2-8/h1-5,14,17,19-22,24-27,32,34-37H,6-7H2,(H4-,28,29,30,31,33)/p+1/t14-,17-,19+,20-,21+,22-,24-,25+,26-/m1/s1 |
InChIKey: | TWYYVOVDSNRIJM-AFAGGVQESA-O |
Canonical Smiles: | C1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC4=C(C=C(C=C4[O+]=C3C5=CC(=C(C(=C5)O)O)O)O)O)CO)O)O)O)O)O |
Isomeric Smiles: | C1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3=CC4=C(C=C(C=C4[O+]=C3C5=CC(=C(C(=C5)O)O)O)O)O)CO)O)O)O)O)O |
Molecular Weight: | 597.5 |
Molecular Formula: | C26H29O16+ |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Delphinidin 3-O-beta-D-sambubioside
Molecular Weight: | 597.5 |
Molecular Formula: | C26H29O16+ |
Hydrogen Bond Donor Count: | 11 |
Hydrogen Bond Acceptor Count: | 15 |
Rotatable Bond Count: | 6 |
Heavy Atom Count: | 42 |
Complexity: | 871 |
Synonyms
Delphinidin 3-O-beta-D-sambubioside
| Delphinidin 3-O-beta-D-sambubioside | Delphinidin 3-O-beta-D-sambubioside |
|---|---|
Delphinidin 3-O-beta-D-sambubioside |
Delphinidin 3-sambubioside |
CHEBI:74810 |
C20491 |
Q27144921 |
Delphinidin-3-O-(2-O-beta-xylopyranosyl-beta-glucopyranoside) |
178275-92-8 |
5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)chromenium-3-yl beta-D-xylopyranosyl-(1->2)-beta-D-glucopyranoside |
Experimental Data
Delphinidin 3-O-beta-D-sambubioside
| 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 | 10 | umol/L | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 100 | umol/L | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 1 | umol/L | Unclear | N2 | 33683565 |
Experimental Data Visualization
Delphinidin 3-O-beta-D-sambubioside
Statistics Data
Delphinidin 3-O-beta-D-sambubioside
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 1 | 3 |
Statistics Data Visualization
Delphinidin 3-O-beta-D-sambubioside
