LMPR0105050008
  LIPID_MAPS_STRUCTURE_DATABASE

 32 35  0     0  0            999 V2000
    7.9399   -4.4567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9399   -3.4120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6750   -2.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6753   -5.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7197   -5.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4549   -4.4567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4549   -3.4120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7197   -2.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2034   -6.1184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1764   -5.9560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0136   -4.9290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4486   -3.0890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0628   -3.9342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4486   -4.7795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0848   -4.4560    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6769   -7.0469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9770   -3.0131    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8409   -1.9798    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4021   -4.2391    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4809   -2.7866    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4549   -5.4989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0376   -5.8198    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7707   -2.0977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7900   -1.8811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0732   -1.3233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2042   -3.0108    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1484   -0.9475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1471   -0.9998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4059   -1.9658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5672   -2.5104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7764   -0.2227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7403   -0.0863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  8  3  1  0     0  0
  7  8  1  0     0  0
  6  7  1  0     0  0
  5  6  1  0     0  0
  4  5  1  0     0  0
  1  4  1  0     0  0
  2  3  2  0     0  0
  1  2  1  0     0  0
  4  9  1  0     0  0
  9 10  2  0     0  0
 10 11  1  0     0  0
 11  1  1  0     0  0
  7 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14  6  1  0     0  0
 11 15  2  0     0  0
  9 16  1  0     0  0
  2 17  1  0     0  0
 17 18  2  0     0  0
  1 19  1  6     0  0
  7 20  1  6     0  0
  6 21  1  1     0  0
  4 22  1  1     0  0
 12 23  1  0     0  0
 23 24  1  0     0  0
 23 25  1  1     0  0
 12 26  1  6     0  0
 24 27  1  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 30  2  0     0  0
 30 24  1  0     0  0
 28 31  1  0     0  0
 28 32  1  0     0  0
M  END
> <LM_ID>
LMPR0105050008

> <COMMON_NAME>
Ophiobolin T

> <SYSTEMATIC_NAME>


> <FORMULA>
C25H34O3

> <MASS>
382.25

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
C25 isoprenoids (sesterterpenes) [PR0105]

> <CLASS_LEVEL4>
Cheilanthane and ophiobolane sesterterpenoids [PR010505]

> <SYNONYMS>


> <INCHI_KEY>
MVOQGQWZPKEXTB-YGMUAOAQSA-N

> <INCHI>
InChI=1S/C25H34O3/c1-15-12-21(27)23-17(14-26)6-7-20-18(8-11-25(20,5)13-19(15)23)16(2)22-9-10-24(3,4)28-22/h6,9-10,12,14,16,18-20,22-23H,7-8,11,13H2,1-5H3/b17-6-/t16-,18-,19-,20+,22?,23+,25-/m1/s1

> <SMILES>
[C@@]12([H])C(=O)C=C(C)[C@@]1([H])C[C@@]1(C)CC[C@]([H])([C@@H](C)C3C=CC(C)(C)O3)[C@]1([H])CC=C2C=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
73386897

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1914427

> <CITATION>
23954177

$$$$