Structure database (LMSD)

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LM IDLMPK15030017
Common Name5-((Z)-tridec-8-en-1-yl)resorcinol
Systematic Name(Z)-5-(tridec-8-en-1-yl)benzene-1,3-diol
Synonyms-
Exact Mass
290.2246 (neutral)    Calculate m/z:
FormulaC19H30O2
CategoryPolyketides [PK]
Main ClassPhenolic lipids [PK15]
Sub ClassAlkyl resorcinols and derivatives [PK1503]
PubChem CID6454482
InChIKeyILUMNMFPGSFYMK-WAYWQWQTSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI1S/C19H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-14-18(20)16-19(21)15-17/h5-6,14-16
,20-21H,2-4,7-13H2,1H3/b6-5-
SMILESC1(O)C=C(CCCCCCC/C=C\CCCC)C=C(O)C=1
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms21Rings1Aromatic Rings1Rotatable Bonds11
 van der Waals
Molecular Volume
321.02Topological Polar
Surface Area
40.46Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
2
 logP5.73Molar
Refractivity
89.84