LMPK12113400
  LIPID_MAPS_STRUCTURE_DATABASE

 32 35  0     0  0            999 V2000
    4.7856   -4.5601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6536   -5.0612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6536   -6.0635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7856   -6.5646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9177   -6.0635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9177   -5.0612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5216   -4.5601    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3895   -5.0611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3895   -6.0635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5216   -6.5646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2574   -4.5600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2574   -3.5578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1255   -3.0567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9934   -3.5578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9934   -4.5600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1255   -5.0611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5216   -7.5668    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1728   -4.3906    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5805   -3.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5772   -3.5798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2463   -2.8367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2244   -3.0446    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9373   -1.8856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6064   -1.1425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9591   -1.6777    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6282   -0.9346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9591   -1.6777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4591   -0.8117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4591   -2.5438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1904   -2.7858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8975   -3.4929    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4492   -1.8199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0     0  0
  2  3  1  0     0  0
  3  4  2  0     0  0
  4  5  1  0     0  0
  5  6  2  0     0  0
  6  1  1  0     0  0
  2  7  1  0     0  0
  7  8  1  0     0  0
  8  9  2  0     0  0
  9 10  1  0     0  0
 10  3  1  0     0  0
  8 11  1  0     0  0
 11 12  2  0     0  0
 12 13  1  0     0  0
 13 14  2  0     0  0
 14 15  1  0     0  0
 15 16  2  0     0  0
 16 11  1  0     0  0
 10 17  2  0     0  0
  6 18  1  0     0  0
 18 19  1  0     0  0
 19 20  1  0     0  0
 20  1  1  0     0  0
 20 21  1  6     0  0
 21 22  1  1     0  0
 21 23  1  0     0  0
 23 24  1  0     0  0
 23 25  1  0     0  0
 23 26  1  0     0  0
 25 27  1  0     0  0
 27 28  1  0     0  0
 27 29  2  0     0  0
 22 30  1  0     0  0
 30 31  2  0     0  0
 30 32  1  0     0  0
M  END
> <LM_ID>
LMPK12113400

> <COMMON_NAME>
Tephroapollin G

> <SYSTEMATIC_NAME>


> <FORMULA>
C25H24O7

> <MASS>
436.15

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ZSZZBDOVOVYPPS-UUOWRZLLSA-N

> <INCHI>
InChI=1S/C25H24O7/c1-14(26)30-24(25(3,4)32-15(2)27)18-13-29-20-11-10-17-19(28)12-21(31-23(17)22(18)20)16-8-6-5-7-9-16/h5-12,18,24H,13H2,1-4H3/t18-,24-/m0/s1

> <SMILES>
C12[C@@H]([C@@H](C(C)(OC(=O)C)C)OC(C)=O)COC1=CC=C1C(=O)C=C(C3C=CC=CC=3)OC=21

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
162985791

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
228354

> <CITATION>
32878453

$$$$