LMPK12070038
  LIPID_MAPS_STRUCTURE_DATABASE

 26 30  0  0  0  0            999 V2000
    8.9122   -4.7012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9122   -5.6698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7511   -6.1542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5900   -5.6698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5900   -4.7012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7511   -4.2169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4289   -6.1542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2678   -5.6698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2678   -4.7012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4289   -4.2169    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1063   -6.1540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1063   -7.1897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0033   -7.7076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9002   -7.1897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9002   -6.1540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0033   -5.6362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4289   -7.1895    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9911   -4.4019    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4216   -5.1855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9911   -5.9692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7390   -7.6740    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0033   -8.6763    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9502   -5.3344    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7465   -6.5676    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.9038   -9.1961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6395   -7.1541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0     0  0
  3  4  1  0     0  0
  4  5  2  0     0  0
  5  6  1  0     0  0
  6  1  2  0     0  0
  4  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10  5  1  0     0  0
  8 11  1  0     0  0
 11 12  1  0     0  0
 12 13  2  0     0  0
 13 14  1  0     0  0
 14 15  2  0     0  0
 15 16  1  0     0  0
 16 11  2  0     0  0
  7 17  1  0     0  0
  1  2  1  0     0  0
 12 17  1  0     0  0
  1 18  1  0     0  0
 18 19  1  0     0  0
 19 20  2  0     0  0
 20  2  1  0     0  0
 14 21  1  0     0  0
 13 22  1  0     0  0
  8 23  1  1     0  0
  7 24  1  1     0  0
 22 25  1  0     0  0
 21 26  1  0     0  0
M  END
> <LM_ID>
LMPK12070038

> <COMMON_NAME>
Ambonane

> <SYSTEMATIC_NAME>
6aS,11aS-Dihydro-9,10methoxy-6H-benzofuro[3,2-c]furo[3,2-g][1]benzopyran

> <FORMULA>
C19H16O5

> <MASS>
324.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Pterocarpans [PK1207]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HHWQSUBEFRHIGU-CXAGYDPISA-N

> <INCHI>
InChI=1S/C19H16O5/c1-20-14-4-3-11-13-9-23-16-8-15-10(5-6-22-15)7-12(16)17(13)24-18(11)19(14)21-2/h3-8,13,17H,9H2,1-2H3/t13-,17-/m1/s1

> <SMILES>
C12OC=CC1=CC1[C@@]3([H])OC4=C(OC)C(OC)=CC=C4[C@@]3([H])COC=1C=2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
185939

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
162912547

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 1888375

> <CITATION>
-

$$$$