Structure Database (LMSD)

OH HO
Common Name
4-Prenyldihydropinosylvin
Systematic Name
Synonyms
LM ID
LMPK13090041
Formula
C19H22O2
Exact Mass
Calculate m/z
282.16198
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Polyketides [PK]
Aromatic polyketides [PK13]
Diphenyl ethers, biphenyls, dibenzyls and stilbenes [PK1309]

String Representations

InChiKey (Click to copy)
WRBJIPNZGJUCOJ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C19H22O2/c1-14(2)8-11-17-18(20)12-16(13-19(17)21)10-9-15-6-4-3-5-7-15/h3-8,12-13,20-21H,9-11H2,1-2H3
SMILES (Click to copy)
C1(C/C=C(\C)/C)=C(O)C=C(CCC2=CC=CC=C2)C=C1O

References

Other Databases

KEGG ID
C10281
CHEBI ID
1926
PubChem CID
442715

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 2
Aromatic Rings 2
Rotatable Bonds 5
Van der Waals Molecular Volume 289.84
Topological Polar Surface Area 40.46
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 2
logP 4.39
Molar Refractivity 86.76

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Created at
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Updated at
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