LMPK12050477
  LIPID_MAPS_STRUCTURE_DATABASE

 38 42  0     0  0            999 V2000
    7.4762    9.4101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4762    8.4275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3275    7.9359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1787    8.4275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1787    9.4101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3275    9.9018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0300    7.9359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8811    8.4275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8811    9.4101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0300    9.9018    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0300    7.1694    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6253    9.9016    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3275    6.9533    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8585    6.7771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7556    6.2592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6523    6.7771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6523    7.8128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9618    6.2594    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6377    6.4568    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2464    7.2950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6377    8.1330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2816    7.2950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7992    8.1914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7992    6.3985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3168    7.2950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6281   10.8451    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6282   12.8149    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3313   13.7954    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1869   11.3379    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8607   13.7793    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3325   10.8430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4797   11.3354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4811   12.3227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3326   12.8128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1854   12.3204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0370   12.8107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
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  4  5  2  0  0  0  0
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  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
  7 11  2  0  0  0  0
  1 12  1  0  0  0  0
  3 13  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
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 22 23  1  0  0  0  0
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 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
 24 27  1  0  0  0  0
 32 38  1  0     0  0
 37 31  1  0     0  0
 31 33  1  0     0  0
 33 34  1  0     0  0
 34 35  1  0     0  0
 35 36  1  0     0  0
 36 37  1  0     0  0
 37 38  1  1     0  0
 34 28  1  6     0  0
 35 29  1  1     0  0
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 33  6  1  1     0  0
M  END
> <LM_ID>
LMPK12050477

> <COMMON_NAME>
Dalpanin

> <SYSTEMATIC_NAME>
3-[ 2,3-Dihydro-6-hydroxy-2-(1-hydroxy-1-methylethyl)benzofuran-5-yl]-8-(beta-D-glucopyranosyl)-2,3-dihydro-5,7-dihydroxy-4H-1-benzopyran-4-one

> <FORMULA>
C26H30O12

> <MASS>
534.17

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FBAPMDCZDDOJRF-VEWMLLAHSA-N

> <INCHI>
InChI=1S/C26H30O12/c1-26(2,35)17-4-9-3-10(12(28)6-15(9)37-17)11-8-36-24-18(20(11)31)13(29)5-14(30)19(24)25-23(34)22(33)21(32)16(7-27)38-25/h3,5-6,11,16-17,21-23,25,27-30,32-35H,4,7-8H2,1-2H3/t11?,16-,17?,21-,22+,23-,25+/m1/s1

> <SMILES>
C1(O)=C([C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C2OCC(C3C(O)=CC4OC(C(O)(C)C)CC=4C=3)C(=O)C=2C(O)=C1

> <KEGG_ID>
C10416

> <HMDB_ID>
-

> <CHEBI_ID>
4310

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
442769

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 1357585

> <CITATION>
-

$$$$