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S-Acetyl dihydroasparagusic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM130414

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₆H₁₀O₃S₂

charge

mass

194.00714

reference

InChIKey

PXKKBEIPDBKGPW-UHFFFAOYSA-N

InChI

InChI=1S/C6H10O3S2/c1-4(7)11-3-5(2-10)6(8)9/h5,10H,2-3H2,1H3,(H,8,9)

SMILES

CC(=O)SCC(CS)C(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:173932 chebi:173932	S-Acetyl dihydroasparagusic acid 2-(acetylsulanylmethyl)-3-sulanylpropanoic acid
hmdb:HMDB0035717	S-Acetyl dihydroasparagusic acid 3-(Acetylsulfanyl)-2-(sulfanylmethyl)propanoate 3-(Acetylsulphanyl)-2-(sulphanylmethyl)propanoate 3-(Acetylsulphanyl)-2-(sulphanylmethyl)propanoic acid 3-(acetylsulfanyl)-2-(sulfanylmethyl)propanoic acid S-Acetyl dihydroasparagusate
hmdb:HMDB35717	secondary/obsolete/fantasy identifier