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(Q82050489)
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English
(5,8a-Dimethyl-1-methylidene-2,8-dioxo-3a,4,5,5a,9,9a-hexahydroazuleno[6,5-b]furan-9-yl) 3-methylbut-2-enoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
pseudoguaiane sesquiterpenoid
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mass
344.4023
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₄O₅
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canonical SMILES
O=C(OC1C2C(=C)C(=O)OC2CC(C)C3C=CC(=O)C13C)C=C(C)C
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Identifiers
InChI
InChI=1S/C20H24O5/c1-10(2)8-16(22)25-18-17-12(4)19(23)24-14(17)9-11(3)13-6-7-15(21)20(13,18)5/h6-8,11,13-14,17-18H,4,9H2,1-3,5H3
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InChIKey
MRMTYUUOUCTELG-UHFFFAOYSA-N
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CAS Registry Number
40737-20-0
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PubChem CID
296217
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
60589428
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20304517
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DSSTOX compound identifier
DTXCID50255649
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NSC number
166126
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