LMPK12112395
  LIPID_MAPS_STRUCTURE_DATABASE

 33 35  0  0  0  0  0  0  0  0999 V2000
   10.9166    7.6044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9226    8.6303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7709    7.0860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6804    7.5710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7065    8.6083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8140    9.1381    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4400    8.6084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5733    9.1712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0678    9.1487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1569    8.6601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1420    7.6107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0048    7.0963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3653    9.1532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3421   10.2120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4473   10.7054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6006   10.1997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0212    6.0707    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7876    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5770    7.0725    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2603    9.1587    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2346   10.7179    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0678    9.9810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1794   10.4940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1794   11.5199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2909   12.0329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0678   12.0329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3464    7.1514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5521    7.6100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7165    7.1276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7165    6.2868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.5062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2280    8.6552    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2280    7.6407    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
  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
 11 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
 13 32  1  0  0  0  0
 32 33  1  0  0  0  0
M  END
> <LM_ID>
LMPK12112395

> <COMMON_NAME>
Dorsmanin D

> <SYSTEMATIC_NAME>
3,5,7-Trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6,8-bis (3-methyl-2-butenyl)-4H-1-benzopyran-4-one

> <FORMULA>
C26H28O7

> <MASS>
452.18

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YRKLNCSPCWVPPC-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C26H28O7/c1-13(2)6-9-16-21(28)17(10-7-14(3)4)26-20(22(16)29)23(30)24(31)25(33-26)15-8-11-18(27)19(12-15)32-5/h6-8,11-12,27-29,31H,9-10H2,1-5H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10599726

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 194258

> <CITATION>
-

$$$$