Products 164030-91-5
CAS 164030-91-5 is the registry number for Dichlorogelignate. Offered by: MedChemExpress. Available pack sizes: 10 mg, 1 mg, 5 mg.
(1S,3R,4R,5R)-3-[(1R,2S)-3-[(1R,2R,3R,5S)-5-carboxy-2,3,5-trihydroxycyclohexyl]oxycarbonyl-1-(3,4-dihydroxyphenyl)-6,7-dihydroxy-1,2-dihydronaphthalene-2-carbonyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid (CAS 164030-91-5) is a chemical compound with the molecular formula C32H34O18 and a molecular weight of 706.6 g/mol. IUPAC name: (1S,3R,4R,5R)-3-[(1R,2S)-3-[(1R,2R,3R,5S)-5-carboxy-2,3,5-trihydroxycyclohexyl]oxycarbonyl-1-(3,4-dihydroxyphenyl)-6,7-dihydroxy-1,2-dihydronaphthalene-2-carbonyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid. InChIKey: GASRZGVXKCYAHZ-YIRMVFTQSA-N.
| Molecular formula | C32H34O18 |
|---|---|
| Molecular weight | 706.6 g/mol |
| IUPAC name | (1S,3R,4R,5R)-3-[(1R,2S)-3-[(1R,2R,3R,5S)-5-carboxy-2,3,5-trihydroxycyclohexyl]oxycarbonyl-1-(3,4-dihydroxyphenyl)-6,7-dihydroxy-1,2-dihydronaphthalene-2-carbonyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid |
| InChIKey | GASRZGVXKCYAHZ-YIRMVFTQSA-N |
| SMILES | C1[C@H]([C@H]([C@@H](C[C@@]1(C(=O)O)O)OC(=O)[C@H]2[C@@H](C3=CC(=C(C=C3C=C2C(=O)O[C@@H]4C[C@@](C[C@H]([C@H]4O)O)(C(=O)O)O)O)O)C5=CC(=C(C=C5)O)O)O)O |
Computed by PubChem (NCBI)
Synonyms:
Dichlorogelignate, orb2564156