LMPR0104210005
  LIPID_MAPS_STRUCTURE_DATABASE

 32 34  0     0  0            999 V2000
    7.6131    9.2745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6131    8.2579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4936    7.7495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3740    8.2579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3740    9.2745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4936    9.7828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4936    6.7328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6131    6.2245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3740    6.2245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3740   10.2912    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3740    7.2411    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4936   10.7828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7471    6.7246    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3260    5.3394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3260    4.3394    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1920    5.8394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0580    5.3394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9241    5.8394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1694    9.6827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6044    8.7647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6131    7.7747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1757    7.6222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1701    9.9110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9471   10.8859    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3115    9.4718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5441    8.4227    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9252    6.8285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2310    6.2049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1747    6.7275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7068    8.1973    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3918    5.8378    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4535    6.7647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  3  7  1  1  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  5 10  1  1  0  0  0
  4 11  1  1  0  0  0
  6 12  1  0     0  0
  8 13  1  0     0  0
 14 15  2  0     0  0
 14 16  1  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 23  5  1  0     0  0
 19 23  1  0     0  0
 22  4  1  0     0  0
 20 21  1  0     0  0
 19 20  1  0     0  0
 23 24  2  0     0  0
 20 25  1  1     0  0
 20 26  1  6     0  0
 21 27  1  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 22 30  1  1     0  0
 29 22  1  0     0  0
 21 30  1  1     0  0
 29 31  1  1     0  0
 29 32  1  6     0  0
 31 14  1  0     0  0
M  END
> <LM_ID>
LMPR0104210005

> <COMMON_NAME>
Clakrefielin A

> <SYSTEMATIC_NAME>


> <FORMULA>
C24H38O6

> <MASS>
422.27

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
C20 isoprenoids (diterpenes) [PR0104]

> <CLASS_LEVEL4>
Eunicellane and asbestinane diterpenoids [PR010421]

> <SYNONYMS>


> <INCHI_KEY>
DVLTVWYLBGCEST-CCQKMTPOSA-N

> <INCHI>
InChI=1S/C24H38O6/c1-6-7-19(27)30-24(5)11-10-18-23(4,28)12-17(26)20-14(2)8-9-16(15(3)13-25)21(20)22(24)29-18/h8,15-16,18,20-22,25,28H,6-7,9-13H2,1-5H3/t15?,16-,18-,20-,21-,22-,23+,24-/m1/s1

> <SMILES>
C1=C(C)[C@@]2(C(=O)C[C@@](O)(C)[C@@H]3O[C@@H]([C@](C)(OC(CCC)=O)CC3)[C@]2([H])[C@@H](C(C)CO)C1)[H]

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171119614

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1382565

> <CITATION>
-

$$$$