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(Q105030233)
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English
(1S,4S,4aR,5R,7aS)-1-hydroxy-1,5-dimethyl-4'-propan-2-ylspiro[5,6,7,7a-tetrahydro-4aH-cyclopenta[d][1,2]dioxine-4,5'-furan]-2'-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4-hydroxy-3'-isopropyl-4,7-dimethyl-5,6,7,7a-tetrahydro-4aH-spiro[cyclopenta[d][1,2]dioxine-1,2'-furan]-5'-one
1 reference
based on heuristic
inferred from SMILES
mass
282.146723804
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₂O₅
0 references
canonical SMILES
O=C1OC2(OOC(O)(C)C3CCC(C)C32)C(=C1)C(C)C
0 references
isomeric SMILES
CC(C)C1=CC(=O)O[C@@]12OO[C@](C)(O)[C@H]1CC[C@@H](C)[C@H]12
0 references
found in taxon
Alpinia japonica
1 reference
stated in
Novel guaiane- and secoguaiane-type sesquiterpenes from Alpinia japonica (THUNB.) MIQ.
Identifiers
InChI
InChI=1S/C15H22O5/c1-8(2)11-7-12(16)18-15(11)13-9(3)5-6-10(13)14(4,17)19-20-15/h7-10,13,17H,5-6H2,1-4H3/t9-,10+,13-,14+,15-/m1/s1
0 references
InChIKey
HLNVEFWIEKHWOI-AVFNUOGKSA-N
0 references
PubChem CID
21637815
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HLNVEFWIEKHWOI-AVFNUOGKSA-N
UniChem compound ID
42613136
1 reference
stated in
UniChem
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