LMPK12050381
  LIPID_MAPS_STRUCTURE_DATABASE

 34 37  0     0  0            999 V2000
    7.6642   10.0041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5482   10.5144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4319   10.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4319    8.9460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3485    8.4168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2650    8.9460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2651   10.0042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3485   10.5333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6646    8.9838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5482    8.4736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3485    7.4050    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1808    8.4170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1808    7.4054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0570    6.8997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9330    7.4054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9330    8.4170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0570    8.9232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5199    6.9517    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5482    7.4617    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7883    8.4779    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7880   10.5099    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0401   10.0781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9951    8.9358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4931    7.1104    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.6175    5.4803    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.7677    3.6969    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6574    5.2421    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4931    2.8374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0817    6.1393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0685    6.2186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6307    5.4008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2060    4.5092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2193    4.4299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7945    3.5382    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
  9 20  1  0  0  0  0
  1 21  1  0  0  0  0
 21 22  1  0  0  0  0
 20 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  1     0  0
M  END
> <LM_ID>
LMPK12050381

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

> <SYSTEMATIC_NAME>
5,4'-Dihydroxy-6,7-dimethoxyisoflavone 4'-O-galactoside

> <FORMULA>
C23H24O11

> <MASS>
476.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YIOGKKRAFIMIAE-SCOKAQRDSA-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>
163004934

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 53862

> <CITATION>
-

$$$$