LMPK12112291
  LIPID_MAPS_STRUCTURE_DATABASE

 37 39  0  0  0  0  0  0  0  0999 V2000
    7.6875    6.6928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6957    7.5186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3735    6.2726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1070    6.6602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1314    7.4950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4150    7.9244    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5482    7.4776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8416    7.9165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0094    7.9387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2745    7.5485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2590    6.7038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9518    6.2868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2816    7.9266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2483    8.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5203    9.1653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8470    8.7447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9618    5.4613    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3834    5.4473    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8271    6.2559    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.9527    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9584    9.2043    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9995    8.7640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2891    9.1629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2791    9.9942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5614   10.3971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9916   10.4171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5581    6.6520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2750    6.2495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2849    5.4219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5739    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0042    5.0181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1269    9.1490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1170    9.9736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3923   10.3804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6759    9.9552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3825   11.1988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9381    7.5477    0.0000 O   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
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  2  1  0  0  0  0
  7  8  1  0  0  0  0
  8  5  1  0  0  0  0
  2  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12  1  2  0  0  0  0
  7 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16  8  2  0  0  0  0
 12 17  1  0  0  0  0
  3 18  2  0  0  0  0
  4 19  1  0  0  0  0
 10 20  1  0  0  0  0
 21 14  1  0  0  0  0
  9 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
  7 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
 16 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  2  0  0  0  0
 34 35  1  0  0  0  0
 34 36  1  0  0  0  0
 13 37  1  0  0  0  0
M  END
> <LM_ID>
LMPK12112291

> <COMMON_NAME>
Petalostemumol G

> <SYSTEMATIC_NAME>


> <FORMULA>
C30H34O7

> <MASS>
506.23

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
JJYTVPNJUZEOPO-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C30H34O7/c1-15(2)7-10-18-13-23(33)26(34)20(12-9-17(5)6)24(18)30-28(36)27(35)25-22(32)14-21(31)19(29(25)37-30)11-8-16(3)4/h7-9,13-14,31-34,36H,10-12H2,1-6H3

> <SMILES>
C12=C(O)C=C(O)C(C/C=C(\C)/C)=C1OC(C1=C(C/C=C(/C)\C)C=C(O)C(O)=C1C/C=C(/C)\C)=C(O)C2=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5480298

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$