Ketcher 09141603412D 1   1.00000     0.00000     0

 32 31  0     0  0            999 V2000
   -5.8003    1.1637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9017    0.6647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6647    0.6647    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5290    1.1637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3934    0.6647    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6304    2.6608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5290    2.1618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6304    3.6589    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3590    3.6589    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4948    4.1580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7660    5.1562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1294    6.5195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6304    5.6553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1313    6.5195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4948    5.1562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3591    5.6553    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9017    5.6553    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9054    5.6553    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9035    6.6533    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9035    4.6572    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9035    5.6553    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0372    1.1637    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0410    6.1543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1768    5.6553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3124    6.1543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5520    5.6553    0.0000 *   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1768    4.6572    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3124    7.1524    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0410    4.1580    0.0000 *   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1728    0.6647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3084    1.1637    0.0000 R   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1728   -0.3334    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  7  4  1  0     0  0
  4  3  1  0     0  0
  3  1  1  0     0  0
  1  2  1  0     0  0
  2 22  1  0     0  0
  4  5  2  0     0  0
  6  8  1  0     0  0
 10  8  1  0     0  0
  7  6  1  0     0  0
 10  9  2  0     0  0
 10 15  1  0     0  0
 15 13  1  0     0  0
 13 11  1  0     0  0
 11 17  1  0     0  0
 13 12  1  0     0  0
 13 14  1  0     0  0
 15 16  1  6     0  0
 17 21  1  0     0  0
 21 18  1  0     0  0
 21 19  2  0     0  0
 21 20  1  0     0  0
 18 23  1  0     0  0
 23 24  1  0     0  0
 24 25  1  0     0  0
 25 26  1  0     0  0
 24 27  1  1     0  0
 25 28  2  0     0  0
 27 29  1  0     0  0
 22 30  1  0     0  0
 30 31  1  0     0  0
 30 32  2  0     0  0
M  CHG  1  20  -1
M  END
> <ID>
CHEBI:133243

> <NAME>
O-[S-(long-chain fatty acyl)pantetheine-4'-phosphoryl]serine(1-) residue

> <DEFINITION>
An O-(S-acylpantetheine-4'-phosphoryl)serine(1?) residue in which the S-acyl group is derived from a long-chain fatty acid.

> <STAR>
2

> <SYNONYM>
O-(S-(long-chain fatty acyl)pantetheine-4'-phosphoryl)serine residue

> <FORMULA>
C15H24N3O9PSR

> <MASS>
453.406

> <MONOISOTOPIC_MASS>
453.09709

> <CHARGE>
-1

> <SMILES>
C(NC(CCNC(=O)[C@@H](C(COP(OC[C@@H](C(*)=O)N*)(=O)[O-])(C)C)O)=O)CSC(*)=O

$$$$