LMPR0104240014
  LIPID_MAPS_STRUCTURE_DATABASE

 22 24  0     0  0            999 V2000
    5.4085   -4.8103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2223   -5.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9115   -6.3587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9053   -6.3587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5943   -5.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0375   -5.5666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1661   -6.5637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4709   -7.2901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4718   -7.2024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1666   -5.0460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8366   -4.9564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7646   -5.3435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8933   -6.3406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0942   -6.9509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3139   -7.1727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4962   -5.9763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7079   -3.9585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3213   -4.2854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5224   -7.0074    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3760   -7.2642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1336   -8.0529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3536   -7.8816    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
  4  5  2  0     0  0
  5  1  1  0     0  0
 10  2  1  0     0  0
  6 10  1  0     0  0
  9  3  1  0     0  0
  8  9  1  0     0  0
  7  8  1  0     0  0
  6 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14  7  2  0     0  0
  4 15  1  0     0  0
  7 16  1  0     0  0
 11 17  2  0     0  0
  2 18  1  6     0  0
  3 19  1  1     0  0
 15 20  1  0     0  0
 15 21  1  0     0  0
 15 22  1  0     0  0
  9 22  1  1     0  0
M  END
> <LM_ID>
LMPR0104240014

> <COMMON_NAME>
Clavufuranolide C

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H30O

> <MASS>
286.23

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
Dolabellane and modified dolabellane diterpenoids [PR010424]

> <SYNONYMS>


> <INCHI_KEY>
GWFUANKORWPORG-PLLMSKFTSA-N

> <INCHI>
InChI=1S/C20H30O/c1-14-7-6-8-15(2)13-17-18-16(19(3,4)21-17)10-12-20(18,5)11-9-14/h8,10,17-18H,1,6-7,9,11-13H2,2-5H3/b15-8+/t17-,18+,20-/m1/s1

> <SMILES>
C1C=C2C(O[C@@H]3CC(C)=CCCC(=C)CC[C@@]1(C)[C@@]23[H])(C)C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171119629

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
153213

> <CITATION>
35097299

$$$$