Structure database (LMSD)

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LM IDLMPK13090018
Common Name4,4'-Dihydroxystilbene
Systematic Name-
Synonyms-
Exact Mass
212.0837 (neutral)    Calculate m/z:
FormulaC14H12O2
CategoryPolyketides [PK]
Main ClassAromatic polyketides [PK13]
Sub ClassDiphenyl ethers, biphenyls, dibenzyls and stilbenes [PK1309]
PubChem CID5282363
KEGG IDC14233
InChIKeyXLAIWHIOIFKLEO-OWOJBTEDSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C14H12O2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h1-10,15-16H/b2-
1+
SMILESC1(O)=CC=C(/C=C/C2=CC=C(O)C=C2)C=C1
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms16Rings2Aromatic Rings2Rotatable Bonds2
 van der Waals
Molecular Volume
203.34Topological Polar
Surface Area
40.46Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
2
 logP3.27Molar
Refractivity
65.14