Ketcher 06242114262D 1   1.00000     0.00000     0

 14 15  0     0  0            999 V2000
   12.3708  -10.8753    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   13.3655  -10.7707    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   11.2830   -8.5274    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2623  -12.5307    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7830  -10.0664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9532  -11.5797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0921   -9.1151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9532  -11.5797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7830  -10.0664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6443  -12.5308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0431   -8.8061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5411  -10.7707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4741   -9.1152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4533  -13.1185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  1  5  1  0     0  0
  2  6  1  0     0  0
  3  7  1  0     0  0
  3 13  1  0     0  0
  4  8  1  0     0  0
  4 14  1  0     0  0
  5  7  2  0     0  0
  5  9  1  0     0  0
  6  8  2  0     0  0
  6 10  1  0     0  0
  7 11  1  0     0  0
  8 12  1  0     0  0
  9 13  2  0     0  0
 10 14  2  0     0  0
M  END
> <ID>
CHEBI:172109

> <NAME>
bis(2-methyl-3-furyl)disulfide

> <DEFINITION>
A member of the class of furans that is disulfane in which both hydrogen's are substituted by 2-methylfuran-3-yl groups. It is a flavouring agent found in meat.

> <STAR>
3

> <SYNONYM>
FEMA 3259; bis(2-methyl-3-furyl)disulphide; bis(2-methyl-3-furyl)disulfide; bis(2-methyl-3-furyl) disulfide; bis(2-methyl-3-furanyl) disulfide; 3,3'-dithiobis[2-methylfuran]; 3,3'-dithiobis(2-methylfuran); 3,3'-dithio-2,2'-dimethyldifuran; 2-methyl-3-[(2-methylfuran-3-yl)disulfanyl]furan; 1,2-bis(2-methylfuran-3-yl)disulfane

> <IUPAC_NAME>
3,3'-disulfanediylbis(2-methylfuran)

> <FORMULA>
C10H10O2S2

> <MASS>
226.310

> <MONOISOTOPIC_MASS>
226.01222

> <CHARGE>
0

> <SMILES>
CC1=C(SSC2=C(C)OC=C2)C=CO1

> <INCHI>
InChI=1S/C10H10O2S2/c1-7-9(3-5-11-7)13-14-10-4-6-12-8(10)2/h3-6H,1-2H3

> <INCHIKEY>
OHDFENKFSKIFBJ-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
28588-75-2

> <CHEMIDPLUS>
28588-75-2

> <NIST_CHEMISTRY_WEBBOOK>
28588-75-2

> <AGRICOLA_CITATION>
IND20399496; IND20605654; IND20605658; IND20613092; IND20613366

> <PUBMED_CITATION>
12568564; 12720398; 18324771; 19358532; 23017405; 25466091; 30372917; 30654581; 31957444; 33102877

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