LMPK12050398
  LIPID_MAPS_STRUCTURE_DATABASE

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   11.5477    9.2933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.3550    7.6332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3137    8.1867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3137    9.2937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.5480    8.2263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.2810    8.7992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
> <LM_ID>
LMPK12050398

> <COMMON_NAME>
Junipegenin B 7-O-glucoside

> <SYSTEMATIC_NAME>
5,7-Dihydroxy-6,3',4'-trimethoxyisoflavone 7-O-glucoside

> <FORMULA>
C24H26O12

> <MASS>
506.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YBTHHPIEZVFXLZ-YDKVSCPQSA-N

> <INCHI>
InChI=1S/C24H26O12/c1-31-12-5-4-10(6-13(12)32-2)11-9-34-14-7-15(23(33-3)20(28)17(14)18(11)26)35-24-22(30)21(29)19(27)16(8-25)36-24/h4-7,9,16,19,21-22,24-25,27-30H,8H2,1-3H3/t16-,19-,21+,22-,24-/m1/s1

> <SMILES>
O([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)C1C(OC)=C(O)C2C(=O)C(C3C=C(OC)C(OC)=CC=3)=COC=2C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44257357

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 13100

> <CITATION>
-

$$$$