This website is for informational and educational purposes only. Please do not self-medicate; contact a medical professional for advice before administration. This website is for informational and educational purposes only. Please do not self-medicate; contact a medical professional for advice before administration.

1,3-Benzenediol, 5-[(1Z)-2-(4-hydroxyphenyl)ethenyl]-

PubChem CID: 5056

Connections displayed (default: 10).
Loading graph...

Compound Synonyms 375823-41-9, 1,3-Benzenediol, 5-[(1Z)-2-(4-hydroxyphenyl)ethenyl]-, (resveratrol), 1,3-Benzenediol, 5-[2-(4-hydroxyphenyl)ethenyl]-, Spectrum_001148, SpecPlus_000391, (Cis-Trans)-Resveratrol, Prestwick0_000508, Prestwick1_000508, Spectrum2_001497, Spectrum3_001821, Spectrum4_001896, MolMap_000045, 5-[2-(4-hydroxyphenyl)vinyl]benzene-1,3-diol, Oprea1_727238, KBioGR_000454, KBioGR_002457, KBioSS_000454, KBioSS_001628, DivK1c_006487, SPBio_001513, SPBio_002356, CHEMBL2019155, KBio1_001431, KBio2_000454, KBio2_001628, KBio2_003022, KBio2_004196, KBio2_005590, KBio2_006764, KBio3_000847, KBio3_000848, KBio3_002965, DTXSID10859420, LUKBXSAWLPMMSZ-UHFFFAOYSA-N, Bio2_000397, Bio2_000877, HMS3267J06, HMS3394I09, HMS3426I09, HMS3654D04, HMS3871F03, AKOS025244084, SB17273, SMP1_000257, NCGC00017352-23, NCI60_002840, SY014849, DB-030329, DB-072954, DB-139429, NS00010180, NS00096464, 5-[2-(4-Hydroxyphenyl)ethenyl]-1,3-benzenediol, Q60998680
Topological Polar Surface Area 60.7
Hydrogen Bond Donor Count 3.0
Heavy Atom Count 17.0
Isotope Atom Count 0.0
Molecular Complexity 246.0
Database Name cmaup_ingredients;hmdb_chem_all;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Uniprot Id P00915, P00918, Q16790, O43570, P07451, P22748, Q9Y2D0, P23280, P43166, Q8N1Q1, Q9ULX7, Q99N23, P35218, n.a.
Iupac Name 5-[2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol
Prediction Hob 1.0
Class Stilbenes
Target Id NPT947, NPT233, NPT948, NPT949, NPT1146, NPT1062, NPT1144, NPT1063, NPT955, NPT3101, NPT954, NPT1143
Xlogp 3.1
Superclass Phenylpropanoids and polyketides
Molecular Formula C14H12O3
Prediction Swissadme 0.0
Inchi Key LUKBXSAWLPMMSZ-UHFFFAOYSA-N
Fcsp3 0.0
Logs -3.36
Rotatable Bond Count 2.0
Logd 2.776
Synonyms 3,4',5-Trihydroxystilbene
Compound Name 1,3-Benzenediol, 5-[(1Z)-2-(4-hydroxyphenyl)ethenyl]-
Kingdom Organic compounds
Prediction Hob Swissadme 0.0
Exact Mass 228.079
Formal Charge 0.0
Monoisotopic Mass 228.079
Hydrogen Bond Acceptor Count 3.0
Molecular Weight 228.24
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 1.0
Molecular Framework Aromatic homomonocyclic compounds
Esol -3.6173843411764706
Inchi InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H
Smiles C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)O
Nring 3.0
Defined Bond Stereocenter Count 0.0
Taxonomy Direct Parent Stilbenes