Structure Database (LMSD)

O P O HO HO O HO P O HO O OH
Common Name
Mevalonate-PP
Systematic Name
3R-methyl-3-hydroxypentanoic acid 5-diphosphate
Synonyms
  • (R)-5-Diphosphomevalonic acid
  • mevalonate-5PP
  • (R)-Mevalonic acid 5-diphosphate
LM ID
LMFA01050416
Formula
C6H14O10P2
Exact Mass
Calculate m/z
308.006226
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty Acids and Conjugates [FA01]
Hydroxy fatty acids [FA0105]
Branched fatty acids [FA0102]

String Representations

InChiKey (Click to copy)
SIGQQUBJQXSAMW-ZCFIWIBFSA-N
InChi (Click to copy)
InChI=1S/C6H14O10P2/c1-6(9,4-5(7)8)2-3-15-18(13,14)16-17(10,11)12/h9H,2-4H2,1H3,(H,7,8)(H,13,14)(H2,10,11,12)/t6-/m1/s1
SMILES (Click to copy)
C(C[C@](C)(O)CCOP(O)(=O)OP(O)(=O)O)(=O)O

References

Other Databases

KEGG ID
C01143
HMDB ID
HMDB0001090
CHEBI ID
15899
PubChem CID
439418
SwissLipids ID
SLM:000000302
PDB ID
DP6
GuidePharm ID
3047

Calculated Physicochemical Properties

Heavy Atoms 18
Rings 0
Aromatic Rings 0
Rotatable Bonds 8
Van der Waals Molecular Volume 237.28
Topological Polar Surface Area 170.82
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 10
logP 0.91
Molar Refractivity 56.99

Reactions

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Reactions graph legend

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Created at
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Updated at
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