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(Q105144063)
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English
(3aR,5S,9E,11aR)-5-hydroxy-10-methyl-3,6-dimethylidene-4,5,7,8,11,11a-hexahydro-3aH-cyclodeca[b]furan-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
5-hydroxy-10-methyl-3,6-dimethylidene-4,5,7,8,11,11a-hexahydro-3aH-cyclodeca[b]furan-2-one
1 reference
based on heuristic
inferred from SMILES
mass
248.1412445
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(3aR,5S,9E,11aS)-5-hydroxy-10-methyl-3,6-dimethylidene-4,5,7,8,11,11a-hexahydro-3aH-cyclodeca[b]furan-2-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3aR,5R,9Z,11aS)-5-hydroxy-10-methyl-3,6-dimethylidene-4,5,7,8,11,11a-hexahydro-3aH-cyclodeca[b]furan-2-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₀O₃
0 references
canonical SMILES
O=C1OC2CC(=CCCC(=C)C(O)CC2C1=C)C
0 references
isomeric SMILES
C=C1CC/C=C(\C)C[C@H]2OC(=O)C(=C)[C@H]2C[C@@H]1O
0 references
found in taxon
Munnozia maronii
1 reference
stated in
Ein neues germacranolid aus Munnozia maronii
Identifiers
InChI
InChI=1S/C15H20O3/c1-9-5-4-6-10(2)13(16)8-12-11(3)15(17)18-14(12)7-9/h5,12-14,16H,2-4,6-8H2,1H3/b9-5+/t12-,13+,14-/m1/s1
0 references
InChIKey
KOZHGHBBKHOGEC-QHRJQUTISA-N
0 references
PubChem CID
162850072
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KOZHGHBBKHOGEC-QHRJQUTISA-N
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