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(Q104992629)
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English
(Z)-3-Methyl-4-[(1S,3Z,6S)-1,4,6-trimethyl-2-oxo-3-cycloheptenyl]-2-butenoic acid
chemical compound
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No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
3-Methyl-4-(1,4,6-trimethyl-2-oxocyclohept-3-en-1-yl)but-2-enoic acid
1 reference
based on heuristic
inferred from SMILES
mass
250.156894564
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Leptosphaeric acid
1 reference
based on heuristic
inferred from InChIKey
chemical formula
C₁₅H₂₂O₃
0 references
canonical SMILES
O=C(O)C=C(C)CC1(C(=O)C=C(C)CC(C)C1)C
0 references
isomeric SMILES
CC1=CC(=O)[C@](C)(C/C(C)=C\C(=O)O)C[C@@H](C)C1
0 references
found in taxon
Artemisia annua
1 reference
stated in
Leptosphaeric Acid, a Metabolite with a Novel Carbon Skeleton from Leptosphaeria sp. IV403, an Endophytic Fungus in Artemisia annua
Identifiers
InChI
InChI=1S/C15H22O3/c1-10-5-11(2)8-15(4,13(16)6-10)9-12(3)7-14(17)18/h6-7,11H,5,8-9H2,1-4H3,(H,17,18)/b12-7-/t11-,15-/m0/s1
0 references
InChIKey
FBHGNSRUMXJCEA-RWZOGLMHSA-N
0 references
PubChem CID
101241737
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
FBHGNSRUMXJCEA-RWZOGLMHSA-N
UniChem compound ID
97257067
1 reference
stated in
UniChem
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