|
Structure
|
|
| Relationships |
Total Number of functionally related protein(s) :
16
Total Number of Articles : 11
|
| PubChem |
5280704
|
| Molecular Formula |
C21H20O10 |
| SMILES |
C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O |
| InChI |
InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21-/m1/s1 |
| synonyms |
- 578-74-5
- Apigetrin
- COSMOSIIN
- Apigenin 7-glucoside
- Cosmosiine
- Cosmosioside
- APIGENIN-7-GLUCOSIDE
- Apigenin 7-O-beta-D-glucoside
- Cosmetin
- Cosemetin
- Cosmoside
- Apigenin 7-O-glucoside
- Apigenin-7-O-glucoside
- UNII-7OF2S66PCH
- Apigenin 7-O-beta-D-glucopyranoside
- 7OF2S66PCH
- apigenin 7-O-beta-glucoside
- NSC-407303
- 7-O-(beta-D-Glucosyl)apigenin
- CHEBI:16778
- Apigenin, 7-beta-D-glucopyranoside
- EINECS 209-430-5
- 7-O-beta-D-Glucosyl-5,7,4'-trihydroxyflavone
- NSC 407303
- 7-O-beta-D-glucosyl-apigenin
- 5-Hydroxy-2-(4-hydroxyphenyl)-7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one
- 7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
- 5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
- 4',5,7-TRIHYDROXYFLAVONE 7-GLUCOSIDE
- 5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside
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| Properties |
| Property |
Value |
| MW |
432.4 g/mol |
| HBD |
6 |
| HBA |
10 |
| Rotatable Bond Count |
4 |
| Exact Mass |
432.10564683 g/mol |
| Monoisotopic Mass |
432.10564683 g/mol |
| Heavy Atom Count |
31 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
5 |
| Covalent Unit Count |
1 |
| Complexity |
675 |
| xlogp |
-0.1 |
| Topological Polar Surface Area |
166 |
|