Marvin  06150617072D          

 23 22  0  0  0  0            999 V2000
    6.4302   -0.1973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158    0.2152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -0.1973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.2152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.1973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.2152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.1973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.2152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.1973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.2152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.1973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.2152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -0.1973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579    0.2152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5724   -0.1973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2868    0.2152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0013   -0.1973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7158    0.2152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4302   -0.1973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1447    0.2152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1447    0.2152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8592   -0.1973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8592   -0.1973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 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
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 21  1  1  0  0  0  0
 22 20  1  0  0  0  0
 23 21  1  0  0  0  0
M  END
> <ID>
CHEBI:32934

> <NAME>
tricosane

> <DEFINITION>
A straight chain alkane containing 23 carbon atoms.

> <STAR>
3

> <SYNONYM>
n-tricosane; CH3-[CH2]21-CH3

> <IUPAC_NAME>
tricosane

> <FORMULA>
C23H48

> <MASS>
324.62722

> <MONOISOTOPIC_MASS>
324.37560

> <CHARGE>
0

> <SMILES>
CCCCCCCCCCCCCCCCCCCCCCC

> <INCHI>
InChI=1S/C23H48/c1-3-5-7-9-11-13-15-17-19-21-23-22-20-18-16-14-12-10-8-6-4-2/h3-23H2,1-2H3

> <INCHIKEY>
FIGVVZUWCLSUEI-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
638-67-5

> <REAXYS_REGISTRY_NUMBER>
1756000

> <CHEMIDPLUS>
638-67-5

> <KEGG_COMPOUND_ACCESSION>
C17433

> <KNAPSACK_ACCESSION>
C00032409

> <LIPID_MAPS_INSTANCE_ACCESSION>
LMFA11000589

> <METACYC_ACCESSION>
CPD-7947

> <NIST_CHEMISTRY_WEBBOOK>
638-67-5

> <PUBMED_CITATION>
22439883; 22724515; 23811454; 24673591; 24687179

$$$$