LMPK12100065
  LIPID_MAPS_STRUCTURE_DATABASE

 23 24  0  0  0  0  0  0  0  0999 V2000
    7.8074   10.9525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6864   11.4600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5651   10.9527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5651    9.9005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4439    9.3930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3227    9.9005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2016    9.3930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8074    9.9381    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6864    9.4308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4439    8.3782    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5701    7.8737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5701    6.8650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4439    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3175    6.8650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3175    7.8738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3227    8.8856    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.1964    8.3812    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4439   11.4601    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9284   11.4598    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9284    9.4305    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1606   11.0166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    9.9315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1519   11.0514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  1  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9  4  1  0  0  0  0
  5 10  1  0  0  0  0
 10 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 10  1  0  0  0  0
  5 16  1  1  0  0  0
 15 17  1  0  0  0  0
  3 18  1  0  0  0  0
  1 19  1  0  0  0  0
  8 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 18 23  1  0  0  0  0
M  END
> <LM_ID>
LMPK12100065

> <COMMON_NAME>
5-O-Methyllatifolin

> <SYSTEMATIC_NAME>


> <FORMULA>
C18H20O4

> <MASS>
300.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Neoflavonoids [PK1210]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(R)-2'-Hydroxy-2,4,5-trimethoxydalbergiquinol

> <INCHI_KEY>
NKFNPUQSPATHPN-GFCCVEGCSA-N

> <INCHI>
InChI=1S/C18H20O4/c1-5-12(13-8-6-7-9-15(13)19)14-10-17(21-3)18(22-4)11-16(14)20-2/h5-12,19H,1H2,2-4H3/t12-/m1/s1

> <SMILES>
C1(OC)C(OC)=CC([C@@]([H])(C2C(O)=CC=CC=2)C=C)=C(OC)C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
178248

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
340212

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 1353466

> <CITATION>
-

$$$$