LMPK12111537
  LIPID_MAPS_STRUCTURE_DATABASE

 34 37  0  0  0  0  0  0  0  0999 V2000
   11.2277    8.6486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2337    9.7098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1437    8.1128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0657    8.6382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0717    9.6994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1557   10.2352    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9098    9.6889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9938   10.2248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3177   10.2457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3957    9.7202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3897    8.6591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3057    8.1232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8219   10.2311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8180   11.3092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9020   11.8449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9898   11.3029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3057    7.3120    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1437    7.3308    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.5797   11.7488    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5564    7.9285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4904    7.9497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9149    8.6502    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6305   10.1619    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7116    9.6314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5607    8.1805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7515    8.6477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9796    8.2022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9796    7.1408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.7327    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9086    7.2253    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4227    6.3840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9621    7.2253    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4632    6.2645    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.3793    6.2645    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
 14 19  1  0  0  0  0
  4 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22  7  1  0  0  0  0
 10 23  1  0  0  0  0
 23 24  1  0  0  0  0
 11 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 21 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  1  0  0  0  0
 30 33  1  0  0  0  0
 33 34  1  0  0  0  0
M  END
> <LM_ID>
LMPK12111537

> <COMMON_NAME>
Artoindonesianin B

> <SYSTEMATIC_NAME>
(+)-6,7-Dihydro-6-(1-hydroperoxy-1-methylethyl)-3,9-dihydroxy-11-methoxy-10-[(1E)-3-methyl-1-butenyl]-8H-[1]benzopyrano[3,2-d][1]benzoxepin-8-one

> <FORMULA>
C26H28O8

> <MASS>
468.18

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
UYYZSBJGWJNBMX-SOFGYWHQSA-N

> <INCHI>
InChI=1S/C26H28O8/c1-13(2)6-8-15-18(31-5)12-20-22(23(15)28)24(29)17-11-21(26(3,4)34-30)32-19-10-14(27)7-9-16(19)25(17)33-20/h6-10,12-13,21,27-28,30H,11H2,1-5H3/b8-6+

> <SMILES>
C12=C(O)C(/C=C/C(C)C)=C(OC)C=C1OC1C3=CC=C(O)C=C3OC(C(OO)(C)C)CC=1C2=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10096171

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 3490

> <CITATION>
10217722

$$$$