LMST01040272
  LIPID_MAPS_STRUCTURE_DATABASE

 43 47  0     0  0            999 V2000
    4.9750   -4.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8410   -5.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8410   -6.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9750   -6.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1090   -6.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1090   -5.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7071   -4.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5731   -5.2749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5731   -6.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7071   -6.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7070   -3.7749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5730   -3.2749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4391   -3.7749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4391   -4.7749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3051   -3.2748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1712   -3.7748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1713   -4.7748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2430   -4.7750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2430   -6.7750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8410   -4.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8410   -7.0750    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4391   -2.7749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7084   -5.5098    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4391   -5.7749    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8410   -3.2750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3051   -2.2748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1711   -1.7747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4390   -1.7748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3050   -1.2748    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0371   -2.2747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9031   -1.7746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1710   -0.7747    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0077   -0.7801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9858   -0.5722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4858   -1.4382    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8167   -2.1813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2645   -0.1110    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0645   -1.2300    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4496   -3.0095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6826   -2.6152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3926    0.3414    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7071   -7.7750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8364   -2.9522    0.0000 H   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  1  0     0  0
  5  6  1  0     0  0
  6  1  1  0     0  0
  2  7  1  0     0  0
  7  8  1  0     0  0
  8  9  2  0     0  0
  9 10  1  0     0  0
 10  3  1  0     0  0
  7 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14  8  1  0     0  0
 13 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 14 17  1  0     0  0
  6 18  1  1     0  0
  5 19  1  1     0  0
  2 20  1  1     0  0
  3 21  1  1     0  0
 13 22  1  1     0  0
  7 23  1  6     0  0
 14 24  1  6     0  0
 11 25  1  6     0  0
 15 26  1  0     0  0
 26 27  1  0     0  0
 26 28  1  6     0  0
 26 29  1  0     0  0
 27 30  1  0     0  0
 30 31  1  0     0  0
 27 32  1  6     0  0
 31 33  1  0     0  0
 33 34  1  0     0  0
 34 35  1  0     0  0
 35 36  1  0     0  0
 36 31  1  0     0  0
 33 37  1  0     0  0
 31 38  1  0     0  0
 36 39  1  0     0  0
 36 40  1  0     0  0
 34 41  2  0     0  0
 10 42  2  0     0  0
 15 43  1  6     0  0
M  END
> <LM_ID>
LMST01040272

> <COMMON_NAME>
Acaulesterone

> <SYSTEMATIC_NAME>
2beta,3beta,11alpha,20beta,22alpha,24,28-heptahydroxy-6-oxo-stigmast-7-en-25,29-lactone

> <FORMULA>
C29H44O11

> <MASS>
568.29

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Stigmasterols and C24-ethyl derivatives [ST0104]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171119177

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST01040272

$$$$