LMPK12050376
  LIPID_MAPS_STRUCTURE_DATABASE

 34 37  0     0  0            999 V2000
    7.8302    9.9170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7171   10.4291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6038    9.9172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6038    8.8554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5232    8.3245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4427    8.8554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4427    9.9172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5232   10.4480    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8302    8.8933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7171    8.3816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5232    7.3029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3273    8.3446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3273    7.3295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2064    6.8221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0855    7.3295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0855    8.3446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2063    8.8521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8957    6.8617    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7171    7.3599    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9455    8.3826    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9455   10.4278    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.8933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1658    9.9776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5432    7.9980    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.3513    7.1392    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.5088    5.1484    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.8800    5.4345    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.8271    3.7515    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7982    6.4345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6219    7.0026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5276    6.5709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6063    5.5756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7825    5.0075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8612    4.0121    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
  7  8  1  0  0  0  0
  8  3  1  0  0  0  0
  1  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  4  1  0  0  0  0
  5 11  2  0  0  0  0
  6 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 17  2  0  0  0  0
 17 12  1  0  0  0  0
 18 15  1  0  0  0  0
 10 19  1  0  0  0  0
  1 21  1  0  0  0  0
  9 20  1  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
 28 34  1  0     0  0
 33 27  1  0     0  0
 27 29  1  0     0  0
 29 30  1  0     0  0
 30 31  1  0     0  0
 31 32  1  0     0  0
 32 33  1  0     0  0
 33 34  1  1     0  0
 29 18  1  1     0  0
 30 24  1  6     0  0
 31 25  1  1     0  0
 32 26  1  6     0  0
M  END
> <LM_ID>
LMPK12050376

> <COMMON_NAME>
7-O-Methyltectorigenin 4'-O-glucoside

> <SYSTEMATIC_NAME>


> <FORMULA>
C23H24O11

> <MASS>
476.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YIOGKKRAFIMIAE-ZTATXHNCSA-N

> <INCHI>
InChI=1S/C23H24O11/c1-30-14-7-13-16(19(27)22(14)31-2)17(25)12(9-32-13)10-3-5-11(6-4-10)33-23-21(29)20(28)18(26)15(8-24)34-23/h3-7,9,15,18,20-21,23-24,26-29H,8H2,1-2H3/t15-,18-,20+,21-,23-/m1/s1

> <SMILES>
C1(OC)C(OC)=C(O)C2C(=O)C(C3C=CC(O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O4)=CC=3)=COC=2C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
163004931

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$