Structure Database (LMSD)

Common Name
(+)-Bornyl-diphosphate
Systematic Name
Synonyms
LM ID
LMPR0102120009
Formula
C10H20O7P2
Exact Mass
Calculate m/z
314.068431
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Level 4 Class
Prenol Lipids [PR]
Isoprenoids [PR01]
C10 isoprenoids (monoterpenes) [PR0102]
Bicyclic monoterpenoids [PR010212]

String Representations

InChiKey (Click to copy)
VZPAJODTZAAANV-ZCUBBSJVSA-N
InChi (Click to copy)
InChI=1S/C10H20O7P2/c1-9(2)7-4-5-10(9,3)8(6-7)16-19(14,15)17-18(11,12)13/h7-8H,4-6H2,1-3H3,(H,14,15)(H2,11,12,13)/t7?,8-,10?/m0/s1
SMILES (Click to copy)
OP(=O)(O)OP(=O)(O)O[C@@]1([H])CC2CCC1(C)C2(C)C

Other Databases

KEGG ID
C03190
PubChem CID
439937

Calculated Physicochemical Properties

Heavy Atoms 19
Rings 2
Aromatic Rings 0
Rotatable Bonds 4
Van der Waals Molecular Volume 258.03
Topological Polar Surface Area 113.29
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 7
logP 3.23
Molar Refractivity 67.16

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Updated at
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