LMPK12110167
  LIPID_MAPS_STRUCTURE_DATABASE

 27 29  0  0  0  0  0  0  0  0999 V2000
    5.9069    7.5902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9069    6.7659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6208    6.3537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3347    6.7659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3347    7.5902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6209    8.0024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0485    6.3537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7624    6.7659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7624    7.5902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0485    8.0023    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0485    5.5295    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4763    8.0024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2039    7.5824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9315    8.0024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9315    8.8426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2039    9.2627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4763    8.8426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6209    8.8268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3007    9.2427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9274    9.1083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5866    9.2850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5423    8.7534    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0627    8.6035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6208    5.5295    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5377    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    8.0024    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    9.2857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 24 25  1  0  0  0  0
 26 27  1  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  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  1  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  9 12  1  0  0  0  0
 12 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 17  2  0  0  0  0
 17 12  1  0  0  0  0
  6 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
 20 23  1  0  0  0  0
  1 26  1  0  0  0  0
  3 24  1  0  0  0  0
M  END
> <LM_ID>
LMPK12110167

> <COMMON_NAME>
cis-Tephrostachin

> <SYSTEMATIC_NAME>


> <FORMULA>
C22H22O5

> <MASS>
366.15

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
CYPXFTCVCNFZNY-KHPPLWFESA-N

> <INCHI>
InChI=1S/C22H22O5/c1-22(2,24)11-10-15-18(25-3)13-19(26-4)20-16(23)12-17(27-21(15)20)14-8-6-5-7-9-14/h5-13,24H,1-4H3/b11-10-

> <SMILES>
C1(OC)=C(/C=C\C(C)(O)C)C2OC(C3C=CC=CC=3)=CC(=O)C=2C(OC)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44257638

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$