Primary Record
sodium lithospermate B
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 101505388
- SMILES
- C1=CC(=C(C=C1C[C@H](C(=O)O)OC(=O)[C@@H]2[C@H](OC3=C(C=CC(=C23)/C=C/C(=O)O[C@H](CC4=CC(=C(C=C4)[O-])O)C(=O)O)O)C5=CC(=C(C=C5)O)O)O)O.[Na+]
- Canonical SMILES
- O=C(/C=C/c1ccc(O)c2c1[C@H](C(=O)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O)[C@@H](c1ccc(O)c(O)c1)O2)O[C@H](Cc1ccc([O-])c(O)c1)C(=O)O.[Na+]
Names & Synonyms
- sodium lithospermate B
- (alphaR)-alpha-[(E)-3-[[(2S)-3beta-[[(R)-2-(3,4-Dihydroxyphenyl)-1-carboxyethoxy]carbonyl]-2alpha-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydrobenzofuran]-4-yl]-1-oxo-2-propenyloxy]-3,4-dihydroxybenzenepropionic acid alpha-sodium salt