LMST02030262
  LIPID_MAPS_STRUCTURE_DATABASE

 36 39  0     0  0            999 V2000
   11.6419   -2.4127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6419   -3.3904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7950   -3.8787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9482   -3.3904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1014   -3.8787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1014   -4.8571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2552   -5.3454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4089   -4.8571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5343   -5.3622    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4089   -3.8787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2552   -3.3904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9482   -5.3454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7950   -4.8571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1014   -2.8687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9482   -4.3682    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9482   -2.4127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7950   -1.9244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1699   -0.1361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2044   -0.2885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5896    0.4715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9404    1.3839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6240    0.3191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0093    1.0791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2733   -0.5933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5208    0.7762    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7950   -2.9015    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3343   -3.3904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3343   -2.4127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4887   -1.9244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4890   -0.9224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3346   -1.4365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7784   -0.5668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8660   -2.2559    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6419   -4.3904    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6419   -1.4026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7949   -0.9244    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1 17  1  0  0  0  0
  1 29  1  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2 27  1  0  0  0  0
  2 34  1  1  0  0  0
  3 13  1  0  0  0  0
  3  4  1  0  0  0  0
  3 26  1  1  0  0  0
  4  5  1  0  0  0  0
  4 15  1  6  0  0  0
  4 16  1  0  0  0  0
  5 11  1  0  0  0  0
  5  6  1  0  0  0  0
  5 14  1  1  0  0  0
  6  7  1  0  0  0  0
  6 12  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  1  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 12 13  1  0  0  0  0
 16 17  1  0  0  0  0
 18 19  1  0  0  0  0
 18 25  2  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  1  0  0  0
 29 31  1  0  0  0  0
 31 32  1  0  0  0  0
 31 33  2  0  0  0  0
  1 35  1  1  0  0  0
 17 36  1  1     0  0
 36 18  1  0  0  0  0
M  END
> <LM_ID>
LMST02030262

> <COMMON_NAME>
Caudatin

> <SYSTEMATIC_NAME>
12beta-[[(2E)-3,4-dimethyl-1-oxo-2-pentenyl]oxy]-3beta,8beta,14beta,17alpha-tetrahydroxy-pregn-5-en-20-one

> <FORMULA>
C28H42O7

> <MASS>
490.29

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Steroids [ST02]

> <SUB_CLASS>
C21 steroids (gluco/mineralocorticoids, progestogins) and derivatives [ST0203]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21633059

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST02030262

$$$$