4'-Hydroxyflavone
PubChem CID: 229016
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| Compound Synonyms | 4'-Hydroxyflavone, 4143-63-9, 2-(4-hydroxyphenyl)-4H-chromen-4-one, 2-(4-hydroxyphenyl)chromen-4-one, Flavone, 4'-hydroxy-, 4H-1-Benzopyran-4-one, 2-(4-hydroxyphenyl)-, NSC-22357, 8I6VZR0K67, CHEMBL327209, NSC 22357, 2H-1-Benzopyran-2-one, 2-(4-hydroxyphenyl)-, 4kzq, NSC22357, 4''-hydroxyflavone, MFCD00017687, 4'-Monohydroxyflavone, ChemDiv2_003923, Oprea1_206844, MLS001049036, SCHEMBL127446, 4'-METHOXYFLAVONE_met003, DTXSID70877680, HMS1380C07, HMS2271H09, BDBM50011446, CCG-18944, STL560667, 2-(4-Hydroxy-phenyl)-chromen-4-one, AKOS003623541, FH67610, IDI1_002638, NCGC00246218-01, FS-10640, SMR000387049, 4 inverted exclamation marka-Hydroxyflavone, DB-049757, CS-0358728, EU-0042507, H1638, NS00116163, T72445, SR-01000471683, SR-01000471683-1, Q27270572 |
|---|---|
| Topological Polar Surface Area | 46.5 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 18.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 353.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P06239, B2RXH2, P51151, Q16637, Q9NUW8, P00811, O15118, P06746, Q96QE3, O95149, P08659, P43220, P38398, P63092, Q13526, Q16236, O95271, P09917, P09467 |
| Iupac Name | 2-(4-hydroxyphenyl)chromen-4-one |
| Prediction Hob | 1.0 |
| Target Id | NPT13, NPT48, NPT537, NPT93, NPT50, NPT538, NPT59, NPT588 |
| Xlogp | 3.2 |
| Molecular Formula | C15H10O3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | SHGLJXBLXNNCTE-UHFFFAOYSA-N |
| Fcsp3 | 0.0 |
| Logs | -3.719 |
| Rotatable Bond Count | 1.0 |
| Logd | 2.963 |
| Compound Name | 4'-Hydroxyflavone |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 238.063 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 238.063 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 238.24 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.1940781777777776 |
| Inchi | InChI=1S/C15H10O3/c16-11-7-5-10(6-8-11)15-9-13(17)12-3-1-2-4-14(12)18-15/h1-9,16H |
| Smiles | C1=CC=C2C(=C1)C(=O)C=C(O2)C3=CC=C(C=C3)O |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Anthocleista Grandiflora (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 2. Outgoing r'ship
FOUND_INto/from Chamaemelum Nobile (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 3. Outgoing r'ship
FOUND_INto/from Helleborus Caucasicus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 4. Outgoing r'ship
FOUND_INto/from Hypoestes Serpens (Plant) Rel Props:Source_db:npass_chem_all - 5. Outgoing r'ship
FOUND_INto/from Lespedeza Homoloba (Plant) Rel Props:Source_db:npass_chem_all - 6. Outgoing r'ship
FOUND_INto/from Lolium Perenne (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 7. Outgoing r'ship
FOUND_INto/from Primula Farinosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 8. Outgoing r'ship
FOUND_INto/from Schkuhria Multiflora (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all