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(1R,2S,3S,5R)-8-azabicyclo[3.2.1]octane-1,2,3-triol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
8-azabicyclo[3.2.1]octane-1,2,3-triol
1 reference
based on heuristic
inferred from SMILES
mass
159.089543276
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1S,2R,3S,5S)-8-azabicyclo[3.2.1]octane-1,2,3-triol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
calystegine A3
1 reference
based on heuristic
inferred from InChI
chemical formula
C₇H₁₃NO₃
0 references
canonical SMILES
OC1CC2NC(O)(CC2)C1O
0 references
isomeric SMILES
O[C@H]1C[C@H]2CC[C@](O)(N2)[C@H]1O
0 references
found in taxon
sweet potato
1 reference
stated in
Pyrrolizidine alkaloids of Ipomoea hederifolia and related species
Ipomoea setifera
1 reference
stated in
Pyrrolizidine alkaloids of Ipomoea hederifolia and related species
Mandragora autumnalis
1 reference
stated in
Substances isolated from Mandragora species
Mandragora officinarum
1 reference
stated in
Substances isolated from Mandragora species
Identifiers
InChI
InChI=1S/C7H13NO3/c9-5-3-4-1-2-7(11,8-4)6(5)10/h4-6,8-11H,1-3H2/t4-,5+,6+,7-/m1/s1
0 references
InChIKey
XOCBOVUINUHZJA-JRTVQGFMSA-N
0 references
PubChem CID
14608506
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XOCBOVUINUHZJA-JRTVQGFMSA-N
UniChem compound ID
178084322
1 reference
stated in
UniChem
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