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(Q105143845)
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English
1-hydroxy-4-[(1S,4S,6R)-4-hydroxy-2,2,6-trimethylcyclohexyl]butan-2-one
chemical compound
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No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
megastigmane
0 references
mass
228.172544628
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₂₄O₃
0 references
canonical SMILES
O=C(CO)CCC1C(C)CC(O)CC1(C)C
0 references
isomeric SMILES
C[C@@H]1C[C@H](O)CC(C)(C)[C@H]1CCC(=O)CO
0 references
found in taxon
Sedum sarmentosum
1 reference
stated in
Bioactive constituents from Chinese natural medicines. XXIII. Absolute structures of new megastigmane glycosides, sedumosides A(4), A(5), A(6), H, and I, and hepatoprotective megastigmanes from Sedum sarmentosum.
Identifiers
InChI
InChI=1S/C13H24O3/c1-9-6-11(16)7-13(2,3)12(9)5-4-10(15)8-14/h9,11-12,14,16H,4-8H2,1-3H3/t9-,11+,12+/m1/s1
0 references
InChIKey
KOJRWPWXFNKOHI-USWWRNFRSA-N
0 references
PubChem CID
16216884
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KOJRWPWXFNKOHI-USWWRNFRSA-N
UniChem compound ID
34059023
1 reference
stated in
UniChem
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