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(Q103817913)
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English
(5-Acetyloxy-6-hydroxy-6,10-dimethyl-3-methylidene-2,7-dioxo-3a,4,5,10,11,11a-hexahydrocyclodeca[b]furan-4-yl) 2-methylprop-2-enoate
group of stereoisomers with the chemical formula C₂₁H₂₆O₈
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Statements
instance of
group of stereoisomers
0 references
subclass of
germacrane sesquiterpenoid
1 reference
inferred from
germacrane sesquiterpenoid
mass
406.162767792
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₆O₈
0 references
canonical SMILES
O=C(OC1C(OC(=O)C)C(O)(C(=O)C=CC(C)CC2OC(=O)C(=C)C21)C)C(=C)C
0 references
found in taxon
Calea ternifolia
1 reference
stated in
Neue germacranolide aus Calea urticifolia
Calea urticifolia
2 references
stated in
Revision of the structures of caleine A and B, germacranolide sesquiterpenes from Calea zacatechichi
stated in
Anti-Hyperglycemic Activity of Major Compounds from Calea ternifolia.
Identifiers
InChI
InChI=1S/C21H26O8/c1-10(2)19(24)29-17-16-12(4)20(25)28-14(16)9-11(3)7-8-15(23)21(6,26)18(17)27-13(5)22/h7-8,11,14,16-18,26H,1,4,9H2,2-3,5-6H3
0 references
InChIKey
COWWBPRRBQOULA-UHFFFAOYSA-N
0 references
PubChem CID
74184152
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
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