Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMPR0103010002
Common NameFarnesyl diphosphate (W)
Systematic NameFarnesyl pyrophosphate
Synonyms-
Exact Mass
382.1310 (neutral)    Calculate m/z:
FormulaC15H28O7P2
CategoryPrenol Lipids [PR]
Main ClassIsoprenoids [PR01]
Sub ClassC15 isoprenoids (sesquiterpenes) [PR0103]
Class Level 4Acyclic farnesane sesquiterpenoids [PR010301]
PubChem CID445713
KEGG IDC00448
HMDB IDHMDB0000961
CHEBI ID17407
SWISSLIPIDS IDSLM:000000307
InChIKeyVWFJDQUYCIWHTN-YFVJMOTDSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C15H28O7P2/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-21-24(19,20)22-23(16,17
)18/h7,9,11H,5-6,8,10,12H2,1-4H3,(H,19,20)(H2,16,17,18)/b14-9+,15-11+
SMILESO(P(=O)(O)OP(O)(=O)O)C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C
MS Spectra-     
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms24Rings0Aromatic Rings0Rotatable Bonds11
 van der Waals
Molecular Volume
361.33Topological Polar
Surface Area
113.29Hydrogen
Bond Donors
3Hydrogen
Bond Acceptors
7
 logP5.43Molar
Refractivity
94.40