LMPK12110935
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0  0  0  0  0  0  0  0999 V2000
    7.5498   10.1575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5498    9.1362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4344    8.6254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3190    9.1362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3190   10.1575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4344   10.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2036    8.6254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0882    9.1362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0882   10.1575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2036   10.6684    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2036    7.8290    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9724   10.6682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8742   10.1476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7756   10.6682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7756   11.7092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8742   12.2298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9724   11.7092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4344    7.7331    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327   10.6294    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8742    9.1067    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9724    8.6256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9555    7.6047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8311    7.0796    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8142    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7219    7.5741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4344   11.6893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5501   12.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5501   13.2209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6659   13.7316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4344   13.7316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8742   13.1407    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4789   12.1152    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2342   11.6794    0.0000 C   0  0  0  0  0  0  0  0  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  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  9 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 17  2  0  0  0  0
 17 12  1  0  0  0  0
  3 18  1  0  0  0  0
  1 19  1  0  0  0  0
 13 20  1  0  0  0  0
  8 21  1  0  0  0  0
 21 20  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
  6 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
 16 31  1  0  0  0  0
 15 32  1  0  0  0  0
 32 33  1  0  0  0  0
M  END
> <LM_ID>
LMPK12110935

> <COMMON_NAME>
Cycloaltilisin

> <SYSTEMATIC_NAME>
(+)-2,8,10-Trihydroxy-3-methoxy-11-(3-methyl-2-butenyl)-6-(2-methyl-1-propenyl)-6H,7H-[1]benzopyrano[4,3-b][1]benzopyran-7-one

> <FORMULA>
C26H26O7

> <MASS>
450.17

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
RVJOJRVPGYKMQS-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C26H26O7/c1-12(2)6-7-14-16(27)10-18(29)22-24(30)23-21(8-13(3)4)32-19-11-20(31-5)17(28)9-15(19)26(23)33-25(14)22/h6,8-11,21,27-29H,7H2,1-5H3

> <SMILES>
C1(O)=C(C/C=C(\C)/C)C2OC3C4C=C(O)C(OC)=CC=4OC(/C=C(\C)/C)C=3C(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0040835

> <CHEBI_ID>
176143

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44258301

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 194251

> <CITATION>
-

$$$$