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(Q104392638)
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Glucoibervirin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 4-methylsulfanyl-N-sulfooxybutanimidothioate
1 reference
based on heuristic
inferred from SMILES
mass
407.037844252
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
beta-D-Glucopyranose, 1-thio-, 1-(4-(methylthio)-N-(sulfoxy)butanimidate)
1 reference
based on heuristic
inferred from InChI
[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-4-methylsulfanyl-N-sulfooxybutanimidothioate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₁H₂₁NO₉S₃
0 references
canonical SMILES
O=S(=O)(O)ON=C(SC1OC(CO)C(O)C(O)C1O)CCCSC
0 references
isomeric SMILES
CSCCC/C(=N/OS(=O)(=O)O)S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
0 references
found in taxon
Brassica oleracea
2 references
stated in
Glucosinolates in cauliflower as biochemical markers for resistance against downy mildew
stated in
Glucosinolates of wild and cultivated Brassica species
Brassica cretica
1 reference
stated in
Glucosinolates of wild and cultivated Brassica species
Brassica incana
1 reference
stated in
Glucosinolates of wild and cultivated Brassica species
Brassica insularis
1 reference
stated in
Glucosinolates of wild and cultivated Brassica species
Brassica macrocarpa
1 reference
stated in
Glucosinolates of wild and cultivated Brassica species
Brassica montana
1 reference
stated in
Glucosinolates of wild and cultivated Brassica species
Brassica rapa
1 reference
stated in
Glucosinolates of wild and cultivated Brassica species
Brassica rupestris
1 reference
stated in
Glucosinolates of wild and cultivated Brassica species
Identifiers
InChI
InChI=1S/C11H21NO9S3/c1-22-4-2-3-7(12-21-24(17,18)19)23-11-10(16)9(15)8(14)6(5-13)20-11/h6,8-11,13-16H,2-5H2,1H3,(H,17,18,19)/b12-7-/t6-,8-,9+,10-,11+/m1/s1
0 references
InChIKey
ZCZCVJVUJGULMO-IIPHORNXSA-N
0 references
PubChem CID
5748606
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
ChEBI ID
79326
mapping relation type
exact match
1 reference
stated in
ChEBI release 2021-03-01
UniChem compound ID
52138803
1 reference
stated in
UniChem
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