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(E)-Raphanusanin

PropertiesImage
MNX_IDMNXM115296 Image of MNXM115296
referencehmdb:HMDB0041083
formulaC6H9NS2
global charge0
mol weight159.279
InChIKeyBVYUPEKENRMVJK-PLNGDYQASA-N
InChIInChI=1S/C6H9NS2/c1-9-4-5-2-3-7-6(5)8/h4H,2-3H2,1H3,(H,7,8)/b5-4-
SMILESCS/C=C1/CCNC1=S
MNX internals
InChI (mnx)InChI=1/C6H9NS2/c1-9-4-5-2-3-7-6(5)8/h4H,2-3H2,1H3,(H,7,8)/b5-4- Image of MNXM115296
SMILES (mnx)[CH3:1][S:9]/[CH:4]=[C:5]1/[CH2:2][CH2:3][N:7]=[C:6]1[SH:8]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0041083
BVYUPEKENRMVJK-PLNGDYQASA-N
(E)-Raphanusanin
(3Z)-3-[(methylsulfanyl)methylidene]pyrrolidine-2-thione
(4Z)-4-[(Methylsulphanyl)methylidene]-3,4-dihydro-2H-pyrrole-5-thiol

hmdb:HMDB41083
secondary/obsolete/fantasy identifier