LMST01031283
  LIPID_MAPS_STRUCTURE_DATABASE

 35 38  0     0  0            999 V2000
    9.5491    7.5845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5435    9.6319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6571    9.1150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6661    8.0918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4392    9.1253    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4356    8.1010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2084    8.0949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2119    9.1191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3273    9.6374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4392   10.1284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3164   10.6331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1982   11.1337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3164   11.5321    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0620   10.6310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9295   11.1275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7935   10.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6608   11.1215    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4356    7.2992    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.7935    9.6141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7850    7.5845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7850    6.5661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6661    6.0587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5491    6.5661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9099    8.0899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0344    7.5845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0344    6.5738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9099    6.0685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7850    8.4582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0232   10.0392    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5361   11.1240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6661    7.2958    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7784    5.8089    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1722    6.0760    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5369   10.6302    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9330   12.1259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  6  1  0  0  0  0
  5  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  5  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
  6  7  1  0  0  0  0
  5 10  1  1  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  1  0  0  0
 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
  6 18  1  6  0  0  0
 16 19  1  0  0  0  0
  4 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23  1  2  0  0  0  0
 20 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 21  1  0  0  0  0
 20 28  1  1  0  0  0
  9 29  1  6  0  0  0
 11 30  1  6  0  0  0
  4 31  1  6  0  0  0
 21 32  1  6     0  0
 26 33  1  1     0  0
  2 34  1  6     0  0
 15 35  2  0     0  0
M  END
> <LM_ID>
LMST01031283

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
3beta,12alpha-hydroxyergosta-7,24(28)-diene

> <FORMULA>
C28H46O2

> <MASS>
414.35

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Ergosterols and C24-methyl derivatives [ST0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MJZWRDOLHZAYBD-UKOHUJIGSA-N

> <INCHI>
InChI=1S/C28H46O2/c1-17(2)18(3)7-8-19(4)23-11-12-24-22-10-9-20-15-21(29)13-14-27(20,5)25(22)16-26(30)28(23,24)6/h10,17,19-21,23-26,29-30H,3,7-9,11-16H2,1-2,4-6H3/t19-,20+,21+,23-,24+,25+,26+,27+,28-/m1/s1

> <SMILES>
C12=CC[C@@]3([H])C[C@@H](O)CC[C@]3(C)[C@@]1([H])C[C@H](O)[C@]1(C)[C@@]([H])([C@@](C)([H])CCC(=C)C(C)C)CC[C@@]21[H]

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 28:2;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
170989712

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
466954

> <CITATION>
35643122

$$$$