LMPK12060012
  LIPID_MAPS_STRUCTURE_DATABASE

 32 36  0     0  0            999 V2000
   14.9311   10.1224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9311   11.0859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0967   11.5674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2625   11.0859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2625   10.1224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0967    9.6406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4281   11.5674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5937   11.0859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5937   10.1224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4281    9.6406    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7597   11.5674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7597   12.5973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8677   13.1123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9756   12.5973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9756   11.5673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8677   11.0522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4281   12.5309    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8270   10.1224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7595    9.6406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2969    8.6985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2551    8.5977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6467    9.4778    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7368    7.7633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2551    6.9289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8677   14.0758    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7961   14.6944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7002    7.7633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4501    6.4644    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1414   13.0791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8425   12.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6068   11.8188    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.5683    9.4110    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
 25 26  1  0  0  0  0
 27 28  1  0  0  0  0
 29 30  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  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  8 11  1  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 16  1  0  0  0  0
 16 11  2  0  0  0  0
  7 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19  9  1  0  0  0  0
  6 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22  1  1  0  0  0  0
 21 23  1  1  0  0  0
 23 24  2  0  0  0  0
 23 27  1  0  0  0  0
 14 29  1  0  0  0  0
 13 25  1  0  0  0  0
  8 31  1  1     0  0
  9 32  1  1     0  0
M  END
> <LM_ID>
LMPK12060012

> <COMMON_NAME>
Amorphigenin

> <SYSTEMATIC_NAME>
8'-Hydroxyrotenone

> <FORMULA>
C23H22O7

> <MASS>
410.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Rotenoid flavonoids [PK1206]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ZJMLELXRQUXRIU-HBGVWJBISA-N

> <INCHI>
InChI=1S/C23H22O7/c1-11(9-24)16-7-14-15(29-16)5-4-12-22(25)21-13-6-18(26-2)19(27-3)8-17(13)28-10-20(21)30-23(12)14/h4-6,8,16,20-21,24H,1,7,9-10H2,2-3H3/t16-,20-,21+/m1/s1

> <SMILES>
C12O[C@@H](C(CO)=C)CC=1C1O[C@]3([H])COC4=C(C=C(OC)C(OC)=C4)[C@]3([H])C(=O)C=1C=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
183897

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
92207

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 48131

> <CITATION>
-

$$$$