LMPK12060049
  LIPID_MAPS_STRUCTURE_DATABASE

 31 35  0     0  0            999 V2000
    7.9016   10.6032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9016    9.6164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7562    9.1231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6107    9.6164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6107   10.6032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7562   11.0966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4652    9.1231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3198    9.6164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3198   10.6032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4652   11.0966    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1739    9.1231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1739    8.0683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0876    7.5408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0013    8.0683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0013    9.1233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0876    9.6508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4652    8.1363    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1292   10.6032    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1743   11.0966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0473   11.0964    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3198    8.6296    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7562   12.0833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9016   12.5766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0473   12.0833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5540   12.9378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0605   12.0833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7562    8.1363    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0876    6.5540    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9423    6.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8560    7.5748    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7105    8.0683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 28 29  1  0  0  0  0
 30 31  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
  7 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19  9  1  0  0  0  0
  1 20  1  0  0  0  0
  8 21  1  0  0  0  0
  6 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 20  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
  3 27  1  0  0  0  0
 13 28  1  0  0  0  0
 14 30  1  0  0  0  0
M  END
> <LM_ID>
LMPK12060049

> <COMMON_NAME>
11-Hydroxytephrosin

> <SYSTEMATIC_NAME>
13,13a-Dihydro-6,7a-dihydroxy-9,10-dimethoxy-3,3-dimethyl-3H-bis[1]benzopyrano[3,4-b:6',5'-e]pyran-7(7aH)-one

> <FORMULA>
C23H22O8

> <MASS>
426.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Rotenoid flavonoids [PK1206]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
OFLCPNIRDVOOEZ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C23H22O8/c1-22(2)6-5-11-14(31-22)8-13(24)19-20(11)30-18-10-29-15-9-17(28-4)16(27-3)7-12(15)23(18,26)21(19)25/h5-9,18,24,26H,10H2,1-4H3

> <SMILES>
C12OC(C)(C)C=CC=1C1OC3COC4=C(C=C(OC)C(OC)=C4)C3(O)C(=O)C=1C(O)=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
13846202

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 48131

> <CITATION>
-

$$$$