LMST01031191
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0     0  0            999 V2000
    8.8011    4.8144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6697    4.3128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6697    3.3098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8011    2.8083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9326    3.3098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9326    4.3128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5382    4.8144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4069    4.3129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4069    3.3098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5382    2.8083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5382    5.8174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4068    6.3189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2754    5.8174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2754    4.8145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1440    6.3190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0128    5.8175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0129    4.8146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1440    7.3219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0127    7.8234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2753    7.8233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8812    7.3220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7498    7.8235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6185    7.3221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7498    8.8266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6185    6.3192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4871    7.8236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0639    2.8083    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6697    5.3157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2754    6.8203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8106    6.5365    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1440    8.0491    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5511    4.0658    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.7150    4.1125    0.0000 O   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  2  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  1  0     0  0
  9 10  2  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  2  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
 15 18  1  0     0  0
 18 19  1  0     0  0
 18 20  1  6     0  0
 19 21  2  0     0  0
 21 22  1  0     0  0
 22 23  1  0     0  0
 22 24  1  6     0  0
 23 25  1  0     0  0
 23 26  1  0     0  0
  5 27  2  0     0  0
  2 28  1  1     0  0
 13 29  1  1     0  0
 15 30  1  6     0  0
 18 31  1  1     0  0
  7 32  1  6     0  0
 17 33  1  1     0  0
M  END
> <LM_ID>
LMST01031191

> <COMMON_NAME>
Ganodermaside B

> <SYSTEMATIC_NAME>
(22E,24R)-15beta-hydroxyergosta-4,6,8(14),22-tetraen-3-one

> <FORMULA>
C28H40O2

> <MASS>
408.30

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MMVSNLKSAHIETF-IBJCVOCSSA-N

> <INCHI>
InChI=1S/C28H40O2/c1-17(2)18(3)7-8-19(4)24-16-25(30)26-22-10-9-20-15-21(29)11-13-27(20,5)23(22)12-14-28(24,26)6/h7-10,15,17-19,23-25,30H,11-14,16H2,1-6H3/b8-7+/t18-,19+,23-,24+,25+,27-,28+/m0/s1

> <SMILES>
C1CC(=O)C=C2C=CC3=C4[C@H](O)C[C@]([H])([C@]([H])(C)/C=C/[C@H](C)C(C)C)[C@@]4(C)CC[C@]3([H])[C@@]12C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 28:5;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
146683964

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
28564; 5315

> <CITATION>
34087503; 21512225

$$$$