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Honokiol

PubChem CID: 72303

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Compound Synonyms Honokiol, 35354-74-6, 5,3'-Diallyl-2,4'-dihydroxybiphenyl, NSC 293100, 3,5'-Diallyl-4,2'-dihydroxybiphenyl, Purinol, 3',5-diallyl-2,4'-biphenyldiol, 3',5-Diallylbiphenyl-2,4'-diol, C18H18O2, 2-(4-hydroxy-3-prop-2-enylphenyl)-4-prop-2-enylphenol, 11513CCO0N, FMLT BSASM H, 4-allyl-2-(3-allyl-4-hydroxy-phenyl)phenol, HONOKIOL [MI], MFCD00016674, HONOKIOL [WHO-DD], NSC-293100, CPD000387107, 3',5-Di-2-propen-1-yl[1,1'-biphenyl]-2,4'-diol, CHEMBL16901, CHEBI:5759, DTXSID30188845, 2-[4-hydroxy-3-(prop-2-en-1-yl)phenyl]-4-(prop-2-en-1-yl)phenol, NSC293100, [1,1'-Biphenyl]-2,4'-diol, 3',5-di-2-propenyl-, (1,1'-BIPHENYL)-2,4'-DIOL, 3',5-DI-2-PROPEN-1-YL-, Honokiol,(S), [1,1'-Biphenyl]-2,4'-diol, 3',5-di-2-propen-1-yl-, (1,1'-BIPHENYL)-2,4'-DIOL, 3',5-DI-2-PROPENYL-, 2-(4-hydroxy-3-prop-2-enyl-phenyl)- 4-prop-2-enyl-phenol, (1P)-3',5-di(prop-2-en-1-yl)[1,1'-biphenyl]-2,4'-diol, 3',5-(5,5'-)Diallyl-[1,1'-biphenyl]-2,4'-(2,2'-)diol, SMR000387107, 3',5-di(prop-2-en-1-yl)biphenyl-2,4'-diol, UNII-11513CCO0N, Honokiol?, -dihydroxydiphenyl, 3',5-diallyl-[1,1'-biphenyl]-2,4'-diol, Honokiol, HO, 3',5-Di-2-propen-1-yl-[1,1'-biphenyl]-2,4'-diol, [1,1'-Biphenyl]-2,4'-diol, 3',5-di-2-propenyl- (9CI), 3',5-Diallyl-2,4'-biphenyldiol, Honokiol, NSC 293100, Y4T, Honokiol (Standard), 5,3&prime, Honokiol - 98%, -Diallyl-2,4&prime, HONOKIOL [INCI], Honokiol, analytical standard, cid_72303, MLS000759481, MLS001048916, MLS001423980, MLS006011755, SCHEMBL133034, REGID_for_CID_72303, GTPL11610, HY-N0003R, DTXCID90111336, 3',1'-biphenyl)-2,4'-diol, HMS2051C12, HMS2271J07, HMS3393C12, HMS3656G03, BCP28282, HY-N0003, 5,3'-Diallyl-biphenyl-2,4'-diol, AC-486, BBL027819, BDBM50157304, HB0328, s2310, STK801954, 3'',5-diallylbiphenyl-2,4''-diol, Honokiol, >=98% (HPLC), powder, 3,5'-diallyl-2',4-dihydroxybiphenyl, AKOS005622639, Honokiol - 98% - Bio-X trade mark, 3',5-Diallyl-2,4'-dihydroxybiphenyl, CCG-100864, CS-1696, FH09766, NC00114, 5,3''-Diallyl-biphenyl-2,4''-diol, SMP2_000040, NCGC00163567-01, NCGC00163567-02, NCGC00163567-03, NCGC00163567-08, AS-15333, BH300084, 5,3''''-Diallyl-biphenyl-2,4''''-diol, H1309, NS00011726, SW197494-3, EN300-7399522, SR-01000758208, Q5896650, SR-01000758208-5, {1,1'-Biphenyl]-2,4'-diol, 3,5-di-2-propenyl-, 3'',5-di-2-propenyl-1,1''-biphenyl-2,4''-diol, BRD-K98493452-001-01-6, BRD-K98493452-001-14-9, Honokiol, European Pharmacopoeia (EP) Reference Standard, Z2065671480, [1,1'-Biphenyl]-2,4'-diol, 3',5-di-2-propen-1-yl, 4-[2-hydroxy-5-(prop-2-en-1-yl)phenyl]-2-(prop-2-en-1-yl)phenol, 609-119-8, N-[[4-([1,2,4]Triazolo[1,5-a]pyridin-6-yl)-5-(6-methylpyridin-2-yl)-1H-imidazol-2-yl]methyl]-2-fluoroaniline, N-?(2-?Fluorophenyl)?-?5-?(6-?methyl-?2-?pyridinyl)?-?4-?[1,?2,?4]?triazolo[1,?5-?a]?pyridin-?6-?yl-1H-?imidazole-?2-?methanamine
Ghose Rule True
Classyfire Kingdom Organic compounds
Topological Polar Surface Area 40.5
Hydrogen Bond Donor Count 2.0
Pfizer 3 75 Rule False
Scaffold Graph Level C1CCC(C2CCCCC2)CC1
Np Classifier Class Neolignans
Deep Smiles C=CCcccccc6)cccccc6)CC=C))))O))))))O
Heavy Atom Count 20.0
Classyfire Class Benzene and substituted derivatives
Scaffold Graph Node Level C1CCC(C2CCCCC2)CC1
Classyfire Subclass Biphenyls and derivatives
Isotope Atom Count 0.0
Molecular Complexity 325.0
Database Name cmaup_ingredients;hmdb_chem_all;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Uniprot Id P05979, P79208, P09917, n.a., P19793, P10636, P51450, Q962Y6, Q194T2, P02791, Q03164, P06746, P10253, O75164, P87108, P31644, P34903, P47869, P28472, P18505, P47870, Q9GZV3, Q8IL88, P39748, P84022, P11021, O75496, P17405, Q99700, P43220, Q77YF9, O42275, P81908, Q9Y2T6, P34972, P21554, Q9NUW8, P37840, B4URF0, Q8WZA2, Q03431, P27695, P18507, P0DTD1, Q9HCN6
Iupac Name 2-(4-hydroxy-3-prop-2-enylphenyl)-4-prop-2-enylphenol
Prediction Hob 1.0
Class Benzene and substituted derivatives
Veber Rule True
Classyfire Superclass Benzenoids
Target Id NPT570, NPT546, NPT51, NPT59, NPT60, NPT1287, NPT232
Xlogp 5.0
Superclass Benzenoids
Subclass Biphenyls and derivatives
Gsk 4 400 Rule False
Molecular Formula C18H18O2
Scaffold Graph Node Bond Level c1ccc(-c2ccccc2)cc1
Prediction Swissadme 0.0
Inchi Key FVYXIJYOAGAUQK-UHFFFAOYSA-N
Silicos It Class Moderately soluble
Fcsp3 0.1111111111111111
Logs -4.176
Rotatable Bond Count 5.0
Logd 3.787
Synonyms honokiol
Esol Class Moderately soluble
Functional Groups C=CC, cO
Compound Name Honokiol
Kingdom Organic compounds
Prediction Hob Swissadme 0.0
Exact Mass 266.131
Formal Charge 0.0
Monoisotopic Mass 266.131
Hydrogen Bond Acceptor Count 2.0
Molecular Weight 266.3
Gi Absorption True
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 0.0
Molecular Framework Aromatic homomonocyclic compounds
Lipinski Rule Of 5 True
Esol -4.7427079999999995
Inchi InChI=1S/C18H18O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h3-4,7-12,19-20H,1-2,5-6H2
Smiles C=CCC1=CC(=C(C=C1)O)C2=CC(=C(C=C2)O)CC=C
Nring 2.0
Np Classifier Biosynthetic Pathway Shikimates and Phenylpropanoids
Defined Bond Stereocenter Count 0.0
Egan Rule True
Taxonomy Direct Parent Biphenyls and derivatives
Np Classifier Superclass Lignans

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