LMPK12080026
  LIPID_MAPS_STRUCTURE_DATABASE

 21 23  0  0  0  0  0  0  0  0999 V2000
    6.2598    9.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2598    8.2270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9652    7.8198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6707    8.2270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6707    9.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9652    9.4489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3761    7.8198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0816    8.2270    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.0816    9.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3761    9.4489    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7870    7.8198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7870    7.0642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4412    6.6866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0954    7.0642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0954    7.8198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4412    8.1974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    9.4489    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0816    7.4126    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0816    6.6570    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8008    6.6570    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8008    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 20 21  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
  1 17  1  0  0  0  0
  8 18  1  1  0  0  0
 12 19  1  0  0  0  0
 14 20  1  0  0  0  0
M  END
> <LM_ID>
LMPK12080026

> <COMMON_NAME>
(+)-Vestitol

> <SYSTEMATIC_NAME>
(3S)-3,4-Dihydro-3-(2-hydroxy-4-methoxyphenyl)-2H-1-benzopyran-7-ol

> <FORMULA>
C16H16O4

> <MASS>
272.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavans [PK1208]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(3S)-Vestitol

> <KEGG_ID>
C10540

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
9971

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FLIC1LNS0003

> <PUBCHEM_COMPOUND_ID>
177149

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/index.php/databases/lmsd/LMPK12080026

$$$$