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(Q115784355)
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English
(4R,5S,6R,7R)-4,5,6,7,8-pentahydroxyoctan-3-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
208.094688232
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₈H₁₆O₆
0 references
canonical SMILES
O=C(CC)C(O)C(O)C(O)C(O)CO
0 references
isomeric SMILES
CCC(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
0 references
found in taxon
Rehmannia glutinosa
1 reference
stated in
Four caffeoyl glycosides from callus tissue of Rehmannia glutinosa
Identifiers
InChI
InChI=1S/C8H16O6/c1-2-4(10)6(12)8(14)7(13)5(11)3-9/h5-9,11-14H,2-3H2,1H3/t5-,6+,7-,8-/m1/s1
0 references
InChIKey
IJPCXCDDMAUNSI-ULAWRXDQSA-N
0 references
PubChem CID
18650032
2 references
stated in
PubChem
retrieved
21 December 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IJPCXCDDMAUNSI-ULAWRXDQSA-N
SureChEMBL ID
SCHEMBL343766
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IJPCXCDDMAUNSI-ULAWRXDQSA-N
UniChem compound ID
79149933
1 reference
stated in
UniChem
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