LMPR0104030002
  LIPID_MAPS_STRUCTURE_DATABASE

 30 31  0  0  0  0  0  0  0  0999 V2000
    6.4520    7.0661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4481    6.2282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1836    7.4793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7241    7.4831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4444    7.8925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7241    5.8075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1760    5.8037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9001    7.0585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1875    8.3171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.0661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.2282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9364    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5004    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9001    6.2207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3096    7.3239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9115    8.7341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6356    8.3058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6280    7.4755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3596    8.7189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3445    7.0547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0724    7.4603    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9064    7.4642    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   11.7442    7.4642    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9026    8.3019    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9026    6.6263    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5821    7.4642    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   13.4198    7.4642    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5782    8.3019    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5782    6.6263    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4444    5.3942    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  1  0  0  0
  2  6  1  0  0  0  0
  2  7  1  0  0  0  0
  3  8  1  0  0  0  0
  3  9  1  1  0  0  0
  4 10  1  0  0  0  0
  6 11  1  0  0  0  0
  6 12  1  0  0  0  0
  6 13  1  0  0  0  0
  7 14  1  0  0  0  0
  8 15  2  0  0  0  0
  9 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 22 25  2  0  0  0  0
 23 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 26 29  2  0  0  0  0
  8 14  1  0  0  0  0
 10 11  1  0  0  0  0
  2 30  1  6  0  0  0
M  END
> <LM_ID>
LMPR0104030002

> <COMMON_NAME>
Copalyl diphosphate

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H36O7P2

> <MASS>
450.19

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
C20 isoprenoids (diterpenes) [PR0104]

> <CLASS_LEVEL4>
Labdane and halimane diterpenoids [PR010403]

> <SYNONYMS>


> <INCHI_KEY>
JCAIWDXKLCEQEO-ATPOGHATSA-N

> <INCHI>
InChI=1S/C20H36O7P2/c1-15(11-14-26-29(24,25)27-28(21,22)23)7-9-17-16(2)8-10-18-19(3,4)12-6-13-20(17,18)5/h11,17-18H,2,6-10,12-14H2,1,3-5H3,(H,24,25)(H2,21,22,23)/b15-11+/t17-,18-,20+/m0/s1

> <SMILES>
[C@]12(C)CCCC(C)(C)[C@]1([H])CCC(=C)[C@@H]2CC/C(/C)=C/COP(=O)(O)OP(=O)(O)O

> <KEGG_ID>
C11901

> <HMDB_ID>
-

> <CHEBI_ID>
30939

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5281990

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$