LMPR0104540002
  LIPID_MAPS_STRUCTURE_DATABASE

 32 37  0     0  0            999 V2000
   10.1663    8.5646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3677    7.9823    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8233    9.2922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6569    7.7079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8668    9.5211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5568    8.5687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8898    8.5480    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3719    6.9885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8131    9.2922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7257    8.8931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5197   10.2321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6218    7.9116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2493    6.8013    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8645    9.5211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0380   10.1139    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5588    8.5687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2948    7.6081    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5984    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1208   10.2363    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6822    9.1550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3180   10.8144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0864   10.7802    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0536   10.1115    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2427    9.5211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2926    7.6081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2228    8.3191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5264    9.6831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6595    8.9014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3180   11.8125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2945    9.8246    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1435    6.8553    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8603   10.5191    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  0  0  0  0
  2  6  1  0  0  0  0
  2  7  1  1  0  0  0
  2  8  1  0  0  0  0
  3  9  1  0  0  0  0
  3 10  1  0  0  0  0
  3 11  1  0  0  0  0
  4 12  1  0  0  0  0
  4 13  1  0  0  0  0
  5 14  1  0  0  0  0
  5 15  1  6  0  0  0
  6 16  1  0  0  0  0
  6 17  1  6  0  0  0
  8 18  2  0  0  0  0
  9 19  1  0  0  0  0
 10 20  1  6  0  0  0
 11 21  1  0  0  0  0
 11 22  1  1  0  0  0
 14 23  1  0  0  0  0
 16 24  1  0  0  0  0
 16 25  1  6  0  0  0
 20 26  1  0  0  0  0
 20 27  1  0  0  0  0
 20 28  1  0  0  0  0
 21 29  2  0  0  0  0
 24 30  2  0  0  0  0
  6 14  1  0  0  0  0
  9  7  1  1  0  0  0
  8 13  1  0  0  0  0
 10 12  1  0  0  0  0
 19 21  1  0  0  0  0
 23 24  1  0  0  0  0
  4 31  1  6  0  0  0
 14 32  1  6  0  0  0
M  END
> <LM_ID>
LMPR0104540002

> <COMMON_NAME>
Ginkgolide B

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H24O10

> <MASS>
424.14

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
SQOJOAFXDQDRGF-NNGCZKEZSA-N

> <INCHI>
InChI=1S/C20H24O10/c1-6-12(23)28-11-9(21)18-8-5-7(16(2,3)4)17(18)10(22)13(24)29-15(17)30-20(18,14(25)27-8)19(6,11)26/h6-11,15,21-22,26H,5H2,1-4H3/t6-,7+,8-,9+,10+,11+,15+,17?,18?,19-,20-/m1/s1

> <SMILES>
C123[C@@H](O)[C@@]4([H])[C@](O)([C@H](C)C(O4)=O)[C@]41C(O[C@]2([H])C[C@@H](C(C)(C)C)C13[C@@H](O)C(O[C@H]1O4)=O)=O

> <KEGG_ID>
C07602

> <HMDB_ID>
-

> <CHEBI_ID>
5356

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6917929

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
3311

> <CITATION>
19455619

$$$$