Compound Summary
Compound Information
C08554
Compound Name: | C08554 |
Compound CID: | 135909833 |
Synonyms: | C08554 5296-79-7 AC1NQY69 Miraxanthin I 4-(E)-2-(1-carboxy-3-methylsulfinyl-propyl)aminovinyl-2,3-dihydropyridine-2,6-dicarboxylic acid More... |
Iupac Name: | (4Z)-4-[2-(1-carboxy-3-methylsulfinylpropyl)iminoethylidene]-2,3-dihydro-1H-pyridine-2,6-dicarboxylic acid |
InChI: | InChI=1S/C14H18N2O7S/c1-24(23)5-3-9(12(17)18)15-4-2-8-6-10(13(19)20)16-11(7-8)14(21)22/h2,4,6,9,11,16H,3,5,7H2,1H3,(H,17,18)(H,19,20)(H,21,22)/b8-2+,15-4? |
InChIKey: | KRWNKOCPQBHMPM-FNHXKPTKSA-N |
Canonical Smiles: | CS(=O)CCC(C(=O)O)N=CC=C1CC(NC(=C1)C(=O)O)C(=O)O |
Isomeric Smiles: | CS(=O)CCC(C(=O)O)N=C/C=C\1/CC(NC(=C1)C(=O)O)C(=O)O |
Molecular Weight: | 358.37 |
Molecular Formula: | C14H18N2O7S |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
C08554
Molecular Weight: | 358.37 |
Molecular Formula: | C14H18N2O7S |
Hydrogen Bond Donor Count: | 4 |
Hydrogen Bond Acceptor Count: | 10 |
Rotatable Bond Count: | 8 |
Heavy Atom Count: | 24 |
Complexity: | 639 |
Synonyms
C08554
| C08554 | C08554 |
|---|---|
C08554 |
5296-79-7 |
AC1NQY69 |
Miraxanthin I |
4-(E)-2-(1-carboxy-3-methylsulfinyl-propyl)aminovinyl-2,3-dihydropyridine-2,6-dicarboxylic acid |
Experimental Data
C08554
| 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 | 25 | umol/L | 9.1 | 9.66 | 6.15 | S | N2 | 32535316 | Active |
Experimental Data Visualization
C08554
Statistics Data
C08554
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 6.15 | 1 | 1 |
Statistics Data Visualization
C08554
