PubChem CID | 10680 |
Molecular Formula | C15H10O2 |
Structure |
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Synonyms |
FLAVONE
525-82-6 2-Phenyl-4H-chromen-4-one 2-Phenylchromone 2-Phenyl-4-chromone Asmacoril 2-phenylchromen-4-one Chromocor Cromaril 2-Phenyl-4H-1-benzopyran-4-one 2-Phenyl-chromen-4-one 2-Phenyl-4-benzopyron 4H-1-Benzopyran-4-one, 2-phenyl- Phenylchromone Cromarile 2-Phenyl-gamma-benzopyrone 2-Phenylbenzopyran-4-one 2-Phenyl-4H-benzopyran-4-one Flavon 2-Phenyl-.gamma.-benzopyrone MFCD00006825 NSC 19028 NSC-19028 NSC19028 2-phenyl-1,4-benzopyrone MLS002638647 CHEMBL275638 S2V45N7G3B DTXSID2022048 CHEBI:42491 NCGC00090962-05 DTXCID602048 2-Phenyl-4H-chromen-4-on CAS-525-82-6 FLN SMR000112315 Flavone (VAN) CCRIS 4288 EINECS 208-383-8 BRN 0157598 UNII-S2V45N7G3B Flavone, Flavone 4hki 2-phenyl-4H-chromone FLAVONE [MI] Maybridge3_005286 bmse000945 CBiol_000263 SCHEMBL18879 GTPL409 5-17-10-00552 (Beilstein Handbook Reference) MLS002177804 MLS002473400 2-Phenylbenzo[b]pyran-4-one BIDD:ER0515 2-phenyl-1-benzopyran-4-one MEGxp0_001685 2-Phenyl-4H-chromen-4-one # ACon1_000055 HMS1446A06 HMS2269O06 HMS3604K19 HY-N2424 Tox21_202987 Tox21_400059 BDBM50028962 ICCB2_000263 LMPK12110097 s3967 STK164205 AKOS000603572 CCG-214679 DB07776 IDI1_016673 NCGC00090962-01 NCGC00090962-02 NCGC00090962-03 NCGC00090962-04 NCGC00090962-06 NCGC00168837-01 NCGC00260532-01 AC-35144 AS-58464 SY012830 DB-052142 CS-0022637 F0015 NS00007856 C10043 F-2700 A829155 EN300-18246169 L001213 CU-00000000060-1 Q2742033 BRD-K86741145-001-01-5 6CC153EB-39A6-42FC-BE96-C8BF1D585E27 11091-19-3 InChI=1/C15H10O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-10 |
IUPAC Name | 2-phenylchromen-4-one |
SMILES | C1=CC=C(C=C1)C2=CC(=O)C3=CC=CC=C3O2 |
Canonical SMILES | C1=CC=C(C=C1)C2=CC(=O)C3=CC=CC=C3O2 |
InChI | InChI=1S/C15H10O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-10H |
InChIKey | VHBFFQKBGNRLFZ-UHFFFAOYSA-N |
Molecular Weight | 222.24 g/mol |
XLogP3 | 3.6 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 1 |
Exact Mass | 222.068 |
Monoisotopic Mass | 222.068 |
Topological Polar Surface Area | 26.3 |
Heavy Atom Count | 17 |
Formal Charge | 0 |
Complexity | 326 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Insect | Gene Symbol | Validation | Reference |
---|---|---|---|
Helicoverpa armigera | CYP321A1 | R | |
Helicoverpa zea | CYP6B8 | X | |
Papilio polyxenes | CYP6B1 | X | |
Spodoptera litura | CYP321A10 | R | |
Spodoptera litura | CYP321A12 | R | |
Spodoptera litura | CYP321A15 | R | |
Spodoptera litura | CYP321A7 | R | |
Spodoptera litura | CYP321A8 | R | |
Spodoptera litura | CYP6AB14 | R |