LMPK15030070
  LIPID_MAPS_STRUCTURE_DATABASE

 26 28  0     0  0            999 V2000
    6.1092   -5.2258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9591   -5.7166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9591   -6.6980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1092   -7.1887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2592   -6.6980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2592   -5.7166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8090   -5.2258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1092   -4.2444    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4093   -7.1887    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6589   -5.7166    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8090   -4.2444    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1092   -8.1701    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    7.8090   -7.1887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8090   -8.1701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3587   -6.6980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3587   -5.7166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5088   -5.2258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5088   -4.2444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9591   -8.6608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5087   -7.1886    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1950   -7.3913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7541   -8.2203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1385   -9.0084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1988   -8.6663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2337   -7.6669    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9061   -8.7928    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
 13 14  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 17 18  1  6     0  0
 17 10  1  0     0  0
 14 19  2  0     0  0
 15 20  1  0     0  0
 21 15  1  0     0  0
 21 22  1  0     0  0
 22 23  2  0     0  0
 23 24  1  0     0  0
 24 25  1  0     0  0
 25 21  1  0     0  0
 26 24  1  0     0  0
 14 26  1  0     0  0
M  END
> <LM_ID>
LMPK15030070

> <COMMON_NAME>
Radicicol D

> <SYSTEMATIC_NAME>


> <FORMULA>
C18H19O7Cl

> <MASS>
382.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Phenolic lipids [PK15]

> <SUB_CLASS>
Alkyl resorcinols and derivatives [PK1503]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
QQPHIAUHVZLJOT-ZPHDGDPNSA-N

> <INCHI>
InChI=1S/C18H19ClO7/c1-8-4-12(21)15-3-2-10(26-15)5-9(20)6-11-16(18(24)25-8)13(22)7-14(23)17(11)19/h2-3,7-8,10,12,15,21-23H,4-6H2,1H3/t8-,10?,12?,15?/m1/s1

> <SMILES>
C1(O)=CC(O)=C(Cl)C2CC(CC3OC(C=C3)C(O)C[C@H](OC(=O)C1=2)C)=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
45271667

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
112175

> <CITATION>
24495105

$$$$