Astragalin
Properties
- Molecular formula
- C21H20O11
- Molar mass
- 448.38 g/mol
- Exact mass
- 448.1006 Da
- Melting point
- 218–220 °C
- logP
- -0.24Crippen estimate
- Polar surface area
- 190.3 Ų
- H-bond donors / acceptors
- 7 / 11
- Rotatable bonds
- 4
- Stereocentres
- S, R, S, S, Rin SMILES atom order
Hazards
Not classified as hazardous under GHS. Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Identifiers
CAS number
480-10-4SMILES
O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12InChIKey
JPUKWEQWGBDDQB-QSOFNFLRSA-NInChI
InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2/t13-,15-,17+,18-,21+/m1/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
16 names · show all
- 4H-1-Benzopyran-4-one, 3-(β-D-glucopyranosyloxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-
- 3-(β-D-Glucopyranosyloxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
- Astragaline
- Kaempferol 3-glucoside
- 3-Glucosylkaempferol
- Kaempferol 3-β-D-glucoside
- Kaempferol 3-β-D-glucopyranoside
- 4′,5,7-Trihydroxyflavone 3-β-D-glucopyranoside
- K 5
- Kaempferol 3-O-β-D-glucoside
- Kaempferol 3-O-β-D-glucopyranoside
- Kaempferol 3-O-glucopyranoside
- Kaempferol 3-O-β-glucoside
- Kaempferol 3-O-glucoside
- Kaemferol 3-O-glucopyranoside
- Kaempherol 3-O-β-D-glucopyranoside
Work with Astragalin
Similar compounds
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Kaempferol 3-O-gentiobioside22149-35-590 % similar
Kaempferol 3-O-sophoroside19895-95-589 % similar
Isoquercetin482-35-987 % similar
Hyperoside482-36-087 % similar
Avicularin572-30-585 % similar
Myricetin 3-O-galactoside15648-86-982 % similar
Kaempferol-3-O-glucorhamnoside40437-72-779 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds