Marvin  06181216532D          

 15 14  0  0  1  0            999 V2000
    9.4045   -4.5216    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.1190   -4.1091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6901   -4.1091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4045   -5.3465    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9757   -4.5216    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8335   -4.5216    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5480   -4.1091    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   12.2623   -4.5216    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5480   -3.2841    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7614   -4.9060    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   12.9768   -4.1091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6913   -4.5216    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   14.4057   -4.1091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1202   -4.5216    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6913   -5.3465    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  6  0  0  0
  3  5  1  0  0  0  0
  2  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
  7 10  1  0  0  0  0
  8 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
 12 15  1  6  0  0  0
M  CHG  1  10  -1
M  END
> <ID>
CHEBI:64717

> <NAME>
sn-glycero-3-phospho-(1'-sn-glycerol)(1-)

> <DEFINITION>
A glycerophosphoglycerol(1−) having (R,S)-configuration.

> <STAR>
3

> <SYNONYM>
sn-glycero-3-phosphonato-(1'-sn-glycerol); sn-glycero-3-phospho-(1'-sn-glycerol); sn-glycero-3-phospho-(1'-sn-glycerol); glycerophosphoglycerol

> <IUPAC_NAME>
(2R)-2,3-dihydroxypropyl (2S)-2,3-dihydroxypropyl phosphate

> <FORMULA>
C6H14O8P

> <MASS>
245.14430

> <MONOISOTOPIC_MASS>
245.04318

> <CHARGE>
-1

> <SMILES>
OC[C@H](O)COP([O-])(=O)OC[C@H](O)CO

> <INCHI>
InChI=1S/C6H15O8P/c7-1-5(9)3-13-15(11,12)14-4-6(10)2-8/h5-10H,1-4H2,(H,11,12)/p-1/t5-,6+

> <INCHIKEY>
LLCSXHMJULHSJN-OLQVQODUSA-M

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