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2-Methyl-4-(beta-D-glucopyranosyloxy)-2-butenenitrile
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(Z)-2-methyl-4-[(3R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-2-enenitrile
1 reference
based on heuristic
inferred from SMILES
2-Methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-2-enenitrile
1 reference
based on heuristic
inferred from SMILES
mass
259.105587264
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
rhodiocyanoside A
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₁H₁₇NO₆
0 references
canonical SMILES
N#CC(=CCOC1OC(CO)C(O)C(O)C1O)C
0 references
isomeric SMILES
C/C(C#N)=C\CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
0 references
found in taxon
Rhodiola rosea
1 reference
stated in
Bioactive constituents from Chinese natural medicines. XXVI. Chemical structures and hepatoprotective effects of constituents from roots of Rhodiola sachalinensis
Rhodiola sachalinensis
1 reference
stated in
Bioactive constituents from Chinese natural medicines. XXVI. Chemical structures and hepatoprotective effects of constituents from roots of Rhodiola sachalinensis
Identifiers
InChI
InChI=1S/C11H17NO6/c1-6(4-12)2-3-17-11-10(16)9(15)8(14)7(5-13)18-11/h2,7-11,13-16H,3,5H2,1H3/b6-2+/t7-,8-,9+,10-,11-/m1/s1
0 references
InChIKey
ZMELGIPFIBWPHX-ZCIPGPJXSA-N
0 references
PubChem CID
101514480
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
97585986
1 reference
stated in
UniChem
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