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(Q105199259)
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English
(3aR,5R,5aR,8aS,9aS)-5,8a-dimethyl-1-methylidene-3a,4,5,5a,9,9a-hexahydroazuleno[6,7-b]furan-2,8-dione
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
pseudoguaiane sesquiterpenoid
1 reference
based on heuristic
inferred from SMILES
mass
246.125594436
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
aromaticin
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3aR,5R,5aR,8aS,9aR)-5,8a-dimethyl-1-methylidene-3a,4,5,5a,9,9a-hexahydroazuleno[6,7-b]furan-2,8-dione
1 reference
based on heuristic
inferred from InChI
(3aS,5R,5aS,8aS,9aR)-5,8a-dimethyl-1-methylidene-3a,4,5,5a,9,9a-hexahydroazuleno[6,7-b]furan-2,8-dione
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₁₈O₃
0 references
canonical SMILES
O=C1OC2CC(C)C3C=CC(=O)C3(C)CC2C1=C
0 references
isomeric SMILES
C=C1C(=O)O[C@@H]2C[C@@H](C)[C@@H]3C=CC(=O)[C@@]3(C)C[C@@H]12
0 references
found in taxon
Psilostrophe villosa
1 reference
stated in
Neue, abgewandelte pseudoguajanolide aus Psilostrophe villosa
Identifiers
InChI
InChI=1S/C15H18O3/c1-8-6-12-10(9(2)14(17)18-12)7-15(3)11(8)4-5-13(15)16/h4-5,8,10-12H,2,6-7H2,1,3H3/t8-,10+,11+,12-,15+/m1/s1
0 references
InChIKey
OSSDUQKWVVZIGP-DPXQDECBSA-N
0 references
PubChem CID
162912495
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OSSDUQKWVVZIGP-DPXQDECBSA-N
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