Marvin  06041311212D          

 18 19  0  0  0  0            999 V2000
    8.0052  -15.6262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0052  -14.7886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7256  -16.0282    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.3183  -14.3865    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.3183  -16.0282    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.4626  -14.7886    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.4626  -15.6262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7256  -14.3865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5979  -14.7886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5979  -15.6262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1663  -16.0282    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.7256  -13.5489    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.8776  -14.3865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1405  -14.8053    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8776  -13.5656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8776  -16.0282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8776  -16.8659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1572  -15.6262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  5  1  1  0  0  0  0
  4  2  1  0  0  0  0
  8  2  1  0  0  0  0
  7  3  2  0  0  0  0
  9  4  2  0  0  0  0
 10  5  2  0  0  0  0
  7  6  1  0  0  0  0
  8  6  2  0  0  0  0
 11  7  1  0  0  0  0
 12  8  1  0  0  0  0
 10  9  1  0  0  0  0
 13  9  1  0  0  0  0
 16 10  1  0  0  0  0
 14 13  1  0  0  0  0
 15 13  1  0  0  0  0
 17 16  1  0  0  0  0
 18 16  1  0  0  0  0
M  END
> <ID>
CHEBI:73908

> <NAME>
2,4-diamino-6,7-diisopropylpteridine

> <DEFINITION>
A member of the class of pteridines that is pteridine in which the hydrogens at positions 2 and 4 are replaced by amino groups, whilst those at positions 6 and 7 are replaced by isopropyl groups.

> <STAR>
3

> <SYNONYM>
vibriostatic reagent; vibriostatic compound OH29; vibriostatic compound O/129; vibriostatic agent O/129; vibriostatic agent; vibriostat reagent; vibriostat; Vibrio Static Agent 0.129; O129; O/129; O 129; AH10639; 0/129

> <IUPAC_NAME>
6,7-diisopropylpteridine-2,4-diamine

> <FORMULA>
C12H18N6

> <MASS>
246.31150

> <MONOISOTOPIC_MASS>
246.15929

> <CHARGE>
0

> <SMILES>
CC(C)c1nc2nc(N)nc(N)c2nc1C(C)C

> <INCHI>
InChI=1S/C12H18N6/c1-5(2)7-8(6(3)4)16-11-9(15-7)10(13)17-12(14)18-11/h5-6H,1-4H3,(H4,13,14,16,17,18)

> <INCHIKEY>
LIVXWXAMTVJGCO-UHFFFAOYSA-N

> <REAXYS_REGISTRY_NUMBER>
268787

> <PUBMED_CITATION>
11394182; 13132906; 1353821; 3008635; 6394970; 7165216

$$$$