|
Structure
|
|
| Relationships |
Total Number of functionally related protein(s) :
248
Total Number of Articles : 112
|
| PubChem |
5280448
|
| Molecular Formula |
C16H12O5 |
| SMILES |
COC1=C(C=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)O)O |
| InChI |
InChI=1S/C16H12O5/c1-20-14-5-2-9(6-13(14)18)12-8-21-15-7-10(17)3-4-11(15)16(12)19/h2-8,17-18H,1H3 |
| synonyms |
- Calycosin
- 20575-57-9
- 3'-hydroxyformononetin
- 7-hydroxy-3-(3-hydroxy-4-methoxyphenyl)chromen-4-one
- 3',7-dihydroxy-4'-methoxyisoflavone
- 7-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-4H-chromen-4-one
- 4H-1-Benzopyran-4-one, 7-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-
- 09N3E8P7TA
- CHEBI:17793
- 7-hydroxy-3-(3-hydroxy-4-methoxy-phenyl)chromen-4-one
- 7-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one
- 7,3'-dihydroxy-4'-methoxyisoflavone
- UNII-09N3E8P7TA
- HSDB 8109
- ?CALYCOSIN
- 3'-hydroxy-formononetin
- CALYCOSIN [USP-RS]
- SCHEMBL73013
- MLS000876988
- CHEMBL241608
- MEGxp0_001325
- ACon1_000650
- DTXSID70174580
- HMS2268B05
- BCP28682
- HY-N0519
- LMPK12050056
- MFCD00210598
- s9038
- AKOS015896719
Click to show/hide the synonyms
|
| Properties |
| Property |
Value |
| MW |
284.26 g/mol |
| HBD |
2 |
| HBA |
5 |
| Rotatable Bond Count |
2 |
| Exact Mass |
284.06847348 g/mol |
| Monoisotopic Mass |
284.06847348 g/mol |
| Heavy Atom Count |
21 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
432 |
| xlogp |
2.4 |
| Topological Polar Surface Area |
76 |
|