LMPK12112299
  LIPID_MAPS_STRUCTURE_DATABASE

 37 40  0  0  0  0  0  0  0  0999 V2000
   10.4006   12.0840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3890   13.0811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2176   11.5945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2468   13.5898    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9892   13.5845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5677   13.5705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6764   13.0902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6764   12.0585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5288   11.5747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2176   10.5973    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8519   13.0765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7171   13.5779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7188   14.5780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8551   15.0767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9914   14.5780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5824   13.0765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5515   15.0588    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5966   14.5811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7359   15.1114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8173   13.6205    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7880   11.5457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7880   10.5483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9242   10.0497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606   10.5483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9242    9.0526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7880    8.5539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7880    7.5566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6516    7.0579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6516    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5153    7.5566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5288   10.5773    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1276   12.0840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1276   13.0811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9914   11.5853    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7884   14.5813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2897   15.4451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7910   14.5813    0.0000 C   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
  4  2  1  0  0  0  0
  2  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  1  2  0  0  0  0
  3 10  2  0  0  0  0
  5 11  2  0  0  0  0
 11 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  5  1  0  0  0  0
 16 12  1  0  0  0  0
 13 17  1  0  0  0  0
  6 18  1  0  0  0  0
 18 19  2  0  0  0  0
 20  7  1  0  0  0  0
  8 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
  9 31  1  0  0  0  0
  3 32  1  0  0  0  0
 32 33  2  0  0  0  0
 33  4  1  0  0  0  0
 33  5  1  0  0  0  0
 32 34  1  0  0  0  0
 19 35  1  0  0  0  0
 35 20  1  0  0  0  0
 35 36  1  0  0  0  0
 35 37  1  0  0  0  0
M  END
> <LM_ID>
LMPK12112299

> <COMMON_NAME>
Dorsmanin C

> <SYSTEMATIC_NAME>
2-(3,4-Dihydroxyphenyl)-6-[(2E)-3,7-dimethyl-2,6-octadienyl]-3,5-dihydroxy-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one

> <FORMULA>
C30H32O7

> <MASS>
504.21

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HHAZEOQNUWGOLG-RQZCQDPDSA-N

> <INCHI>
InChI=1S/C30H32O7/c1-16(2)7-6-8-17(3)9-11-19-24(33)23-25(34)26(35)27(18-10-12-21(31)22(32)15-18)36-29(23)20-13-14-30(4,5)37-28(19)20/h7,9-10,12-15,31-33,35H,6,8,11H2,1-5H3/b17-9+

> <SMILES>
C12=C(O)C(C/C=C(/CC/C=C(\C)/C)\C)=C3OC(C)(C)C=CC3=C1OC(C1C=CC(O)=C(O)C=1)=C(O)C2=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
179725

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5472481

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 194258

> <CITATION>
-

$$$$