LMPK15030073
  LIPID_MAPS_STRUCTURE_DATABASE

 24 26  0     0  0            999 V2000
    6.1993   -5.3029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0618   -5.8009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0618   -6.7968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1993   -7.2947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3368   -6.7968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3368   -5.8009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9242   -5.3029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1993   -4.3070    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4743   -7.2947    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7866   -5.8009    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9242   -4.3070    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1993   -8.2906    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    7.8988   -7.2947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5115   -6.7968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5115   -5.8009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6490   -5.3029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6490   -4.3070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2461   -8.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2314   -8.0033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7695   -8.8645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1168   -9.6423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1753   -9.2620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7504   -8.6016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0132   -7.6208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  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
  2  7  1  0     0  0
  1  8  1  0     0  0
  5  9  1  0     0  0
  7 10  1  0     0  0
  7 11  2  0     0  0
  4 12  1  0     0  0
  3 13  1  0     0  0
 14 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  6     0  0
 16 10  1  0     0  0
 13 18  1  0     0  0
 18 19  1  0     0  0
 19 20  1  0     0  0
 20 21  2  0     0  0
 21 22  1  0     0  0
 22 18  2  0     0  0
 20 23  1  0     0  0
 23 24  1  0     0  0
 24 14  2  0     0  0
M  END
> <LM_ID>
LMPK15030073

> <COMMON_NAME>
Pochonin H

> <SYSTEMATIC_NAME>


> <FORMULA>
C18H17O5Cl

> <MASS>
348.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Phenolic lipids [PK15]

> <SUB_CLASS>
Alkyl resorcinols and derivatives [PK1503]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FMTPUVKFUGIZNF-VMZHVLLKSA-N

> <INCHI>
InChI=1S/C18H17ClO5/c1-10-4-2-3-5-11-6-7-12(24-11)8-13-16(18(22)23-10)14(20)9-15(21)17(13)19/h2-3,6-7,9-10,20-21H,4-5,8H2,1H3/b3-2+/t10-/m1/s1

> <SMILES>
C1(O)=CC(O)=C(Cl)C2CC3=CC=C(CC=CC[C@H](OC(=O)C1=2)C)O3

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
102035230

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
280754

> <CITATION>
-

$$$$