Compound: baicalein
SMILES: O=c1c2c(O)c(O)c(O)cc2oc(c1)-c3ccccc3
InChIKey: FXNFHKRTJBSTCS-UHFFFAOYSA-N
Synonyms: baicalein, 491-67-8, 5,6,7-Trihydroxyflavone, Noroxylin, 5,6,7-trihydroxy-2-phenyl-4H-chromen-4-one, 5,6,7-trihydroxy-2-phenylchromen-4-one, 5,6,7-Trihydroxy-2-phenyl-4H-1-benzopyran-4-one, NSC-661431, CHEBI:2979, DTXSID2022389, 49QAH60606, RefChem:5579, DTXCID802389, 637-183-7, MFCD00017459, 5,6,7-trihydroxy-2-phenyl-chromen-4-one, 4H-1-Benzopyran-4-one, 5,6,7-trihydroxy-2-phenyl-, NSC661431, CHEMBL8260, 5,7-Trihydroxyflavone, Biacalein, BaiKalein, SMR000112462, SR-01000597499, NSC 661431, Baicalein;, Sho-saiko-to, UNII-49QAH60606, Baicalein, 8, 3WL, Baicalein, 14, Baicalein, 98%, Baicalein (Standard), Baicalein (Noroxylin), Spectrum_000427, Tocris-1761, SpecPlus_000758, BAICALEIN [MI], Spectrum2_000466, Spectrum3_001608, Spectrum4_000537, Spectrum5_001418, Epitope ID:613417, 5,6,7-trihydroxy flavone, BAICALEIN [USP-RS], BAICALEIN [WHO-DD], Oprea1_765614, BSPBio_003215, KBioGR_001173, KBioSS_000907, MLS002473007, MLS006011756, BIDD:ER0121, DivK1c_006854, SCHEMBL139617, SPECTRUM1504002, SPBio_000572, GTPL5144, orb3140062, SCHEMBL29385549, HY-N0196R, KBio1_001798, KBio2_000907, KBio2_003475, KBio2_006043, KBio3_002435, BAICALEIN(SH)NOW RG GRADE, HMS1922O22, HMS2267F15, HMS3268C22, HMS3412F14, HMS3649O19, HMS3655P18, HMS3676F14, HMS5080M22, ALBB-028286, HY-N0196, SAI_0006, TNP00121, BBL027840, BDBM50009001, CCG-38705, EBC-11085, LMPK12111095, NSC729192, NSC843014, s2268, SBB067246, STL146746, AKOS005747014, AC-7991, CS-6159, FT66348, NSC-729192, NSC-843014, SDCCGMLS-0066744.P001, Baicalein, analytical reference material, SMP1_000037, NCGC00017236-01, NCGC00017236-02, NCGC00017236-03, NCGC00017236-04, NCGC00017236-05, NCGC00017236-06, NCGC00017236-07, NCGC00017236-08, NCGC00017236-10, NCGC00017236-11, NCGC00017236-21, NCGC00025282-01, NCGC00025282-02, NCGC00025282-03, NCGC00025282-04, NCGC00178204-01, AS-57923, PD132943, ST057152, SY057137, 5,6,7-Trihydroxy-2-phenyl-chroman-4-one, NS00097437, SW219229-1, T2721, EN300-303171, S00113, 5,7-Trihydroxy-2-phenyl-4H-1-benzopyran-4-one, AA-504/20839002, F979938, Q2879363, SR-01000597499-1, SR-01000597499-3, SR-01000597499-4, SR-01000597499-6, BRD-K72327355-001-02-2, BRD-K72327355-001-06-3, BRD-K72327355-001-13-9, BRD-K72327355-001-14-7, BRD-K72327355-001-15-4, Z1824568302
Theoretical properties:
molecular_formula: C15H10O5
molecular_weight: 270.24 g/mol
exact_mass: 270.05282342 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 3
hydrogen_bond_acceptor_count: 5
rotatable_bond_count: 1
heavy_atom_count: 20
topological_polar_surface_area: 87 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: Baicalein is a trihydroxyflavone with the hydroxy groups at positions C-5, -6 and -7. It has a role as an EC 4.1.1.17 (ornithine decarboxylase) inhibitor, an EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor, an anticoronaviral agent, a ferroptosis inhibitor, a geroprotector, an antioxidant, an antibacterial agent, an antineoplastic agent, an antifungal agent, an angiogenesis inhibitor, a radical scavenger, a hormone antagonist, a prostaglandin antagonist, an EC 1.13.11.31 (arachidonate 12-lipoxygenase) inhibitor, an EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor, an anti-inflammatory agent, an apoptosis inducer, an EC 3.4.21.26 (prolyl oligopeptidase) inhibitor and a plant metabolite. It is a conjugate acid of a baicalein(1-).
chebi: A trihydroxyflavone with the hydroxy groups at positions C-5, -6 and -7.
chembl: BAICALEIN is a small molecule listed in the ChEMBL database and has reached clinical trial phase 2.0.
wikipedia: Baicalein (5,6,7-trihydroxyflavone) is a flavone, a type of flavonoid, originally isolated from the roots of Scutellaria baicalensis and Scutellaria lateriflora. It is also a constituent of Oroxylum indicum (Indian trumpetflower) and thyme. It is the aglycone of baicalin.