LMPR0103090036
  LIPID_MAPS_STRUCTURE_DATABASE

 25 28  0     0  0            999 V2000
    5.3988   -4.4820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2809   -4.9913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2809   -6.0100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5166   -6.0100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5166   -4.9913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1632   -4.4820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0453   -4.9912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0453   -6.0100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1632   -6.5193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0772   -4.0073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1631   -5.5006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3988   -6.5193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6603   -7.1305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0173   -6.9939    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8025   -6.6915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3881   -7.6222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3749   -7.5157    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9274   -4.4819    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8975   -8.5043    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9274   -3.4633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8096   -2.9539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0453   -2.9539    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8096   -1.9353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9274   -1.4260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6756   -3.4539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  4  5  1  0     0  0
  5  1  1  0     0  0
  2  6  1  0     0  0
  6  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9  3  1  0     0  0
  2 10  1  6     0  0
  1 10  1  1     0  0
  2 11  1  0     0  0
  3 12  1  0     0  0
 12  4  1  0     0  0
 12 13  1  0     0  0
  3 14  1  1     0  0
 12 14  1  6     0  0
  8 15  1  1     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
  9 17  1  6     0  0
  7 18  1  1     0  0
 16 19  2  0     0  0
 18 20  1  0     0  0
 20 21  1  0     0  0
 20 22  2  0     0  0
 21 23  2  0     0  0
 23 24  1  0     0  0
 21 25  1  0     0  0
M  END
> <LM_ID>
LMPR0103090036

> <COMMON_NAME>
1,10-epoxydeltoidin A

> <SYSTEMATIC_NAME>


> <FORMULA>
C19H26O6

> <MASS>
350.17

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
C15 isoprenoids (sesquiterpenes) [PR0103]

> <CLASS_LEVEL4>
Germacrane sesquiterpenoids [PR010309]

> <SYNONYMS>


> <INCHI_KEY>
ODHOUUHGBKXLJZ-ILPIULFJSA-N

> <INCHI>
InChI=1S/C19H26O6/c1-5-10(2)17(21)22-12-9-19(4)13(24-19)6-7-18(3)16(25-18)15-11(12)8-14(20)23-15/h5,11-13,15-16H,6-9H2,1-4H3/b10-5-/t11-,12-,13-,15+,16+,18-,19+/m1/s1

> <SMILES>
[C@H]12O[C@@]1(C)C[C@@H](OC(=O)/C(/C)=C\C)[C@H]1CC(=O)O[C@@H]1[C@@H]1O[C@]1(C)CC2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171118748

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
102749

> <CITATION>
32998543

$$$$