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English
Calystegine B3
group of stereoisomers with the chemical formula C₇H₁₃NO₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
Calystegin B2
1 reference
based on heuristic
inferred from SMILES
mass
175.084457896
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₇H₁₃NO₄
0 references
canonical SMILES
OC1C(O)C2NC(O)(CC2)C1O
0 references
isomeric SMILES
O[C@H]1C2CC[C@](O)(N2)[C@H](O)[C@@H]1O
0 references
found in taxon
Mandragora autumnalis
1 reference
stated in
Calystegine distribution in some solanaceous species
Mandragora officinarum
1 reference
stated in
Calystegine distribution in some solanaceous species
Identifiers
InChI
InChI=1S/C7H13NO4/c9-4-3-1-2-7(12,8-3)6(11)5(4)10/h3-6,8-12H,1-2H2/t3?,4-,5+,6+,7+/m0/s1
0 references
InChIKey
FXFBVZOJVHCEDO-NSULPUJOSA-N
0 references
PubChem CID
45109756
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
FXFBVZOJVHCEDO-NSULPUJOSA-N
UniChem compound ID
61211218
1 reference
stated in
UniChem
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