LMFA07050152
  LIPID_MAPS_STRUCTURE_DATABASE

 55 57  0  0  0  0            999 V2000
   24.7785   -1.4464    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   24.1111   -0.9615    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   23.4436   -1.4464    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   23.6986   -2.2310    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   25.0085   -2.8985    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.0328   -5.4874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7756   -5.8999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3183   -5.8999    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.6039   -5.4874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8894   -5.8999    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.3467   -4.2499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6039   -4.6624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3467   -3.4249    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.9178   -3.4249    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.6322   -3.0123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0612   -2.1873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9342   -1.0604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3467   -1.7748    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   17.7592   -1.0604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6322   -2.1873    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   15.9177   -1.7748    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.7756   -1.7748    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.4256   -1.7748    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.0756   -1.7748    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.6006   -0.9498    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.6006   -2.5998    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.2506   -0.9498    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.2506   -2.5998    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.6006   -1.7748    0.0000 P   0  0  3  0  0  0  0  0  0  0  0  0
   21.2506   -1.7748    0.0000 P   0  0  3  0  0  0  0  0  0  0  0  0
   22.6590   -1.1915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.2136   -2.8985    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.3886   -3.7235    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.0386   -3.7235    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.2136   -3.7235    0.0000 P   0  0  3  0  0  0  0  0  0  0  0  0
   23.2136   -4.5485    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   25.5631   -1.1915    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   26.1763   -1.7435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.8987   -0.4378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.8907   -1.3310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.1763   -2.5685    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   26.7192   -0.5240    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   27.6052   -1.7434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.8908   -2.9809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.6052   -2.5684    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   28.3196   -1.3309    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.4901   -5.4874    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   20.2045   -5.8999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2045   -6.7249    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.6335   -6.7249    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.6335   -5.8999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3480   -5.4874    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.9190   -5.4874    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   20.9190   -4.6624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 38  1  1  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  3  6  1  6  0  0  0
  4 32  1  1  0  0  0
  5  4  1  0  0  0  0
  5 33  1  6  0  0  0
  9  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8 48  1  0  0  0  0
 10  9  1  0  0  0  0
 13 10  1  0  0  0  0
 10 11  2  0  0  0  0
 12 14  1  0  0  0  0
 13 12  1  0  0  0  0
 16 14  1  0  0  0  0
 16 15  2  0  0  0  0
 16 21  1  0  0  0  0
 19 17  1  0  0  0  0
 17 23  1  0  0  0  0
 19 18  1  0  0  0  0
 21 19  1  0  0  0  0
 19 20  1  0  0  0  0
 21 22  1  6  0  0  0
 23 30  1  0  0  0  0
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 30 27  1  0  0  0  0
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M  END
> <LM_ID>
LMFA07050152

> <COMMON_NAME>
(R)-methylmalonyl-CoA

> <SYSTEMATIC_NAME>
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2R)-2-methyl-3-oxopropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}

> <FORMULA>
C25H40N7O19P3S

> <MASS>
867.13

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Fatty acyl CoAs [FA0705]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
METHYLMALONYL-COENZYME A

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
15465

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
SLM:000485354

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
449534

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://dev.lipidmaps.org/databases/lmsd/LMFA07050152

$$$$