201815-03-4 Purity
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Specification
The molecular formula of saponarin is C27H30O15.
The molecular weight of saponarin is 594.5 g/mol.
The IUPAC name of saponarin is 5-hydroxy-2-(4-hydroxyphenyl)-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-7-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one.
The Canonical SMILES of saponarin is C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)C5C(C(C(C(O5)CO)O)O)O)O)O.
The CAS number of saponarin is 20310-89-8.
Saponarin has 10 hydrogen bond donor counts.
Saponarin has 15 hydrogen bond acceptor counts.
The XLogP3-AA value of saponarin is -1.6.
The InChIKey of saponarin is HGUVPEBGCAVWID-KETMJRJWSA-N.
Saponarin is a natural product found in Hibiscus syriacus, Moraea sisyrinchium, and other organisms with available data.