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(Q104667994)
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English
(1,3-Diacetyloxy-4a,7-dihydroxy-4,4,7,11b-tetramethyl-1,2,3,5,6,6a,11,11a-octahydronaphtho[2,1-f][1]benzofuran-2-yl) acetate
group of stereoisomers with the chemical formula C₂₆H₃₆O₉
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Statements
instance of
group of stereoisomers
0 references
subclass of
cassane diterpenoid
1 reference
inferred from
cassane diterpenoid
mass
492.235932732
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₆H₃₆O₉
0 references
canonical SMILES
O=C(OC1C(OC(=O)C)C(C)(C)C2(O)CCC3C(CC=4OC=CC4C3(O)C)C2(C)C1OC(=O)C)C
0 references
found in taxon
Caesalpinia crista
1 reference
stated in
New Cassane-Type Diterpenes of Caesalpinia crista from Myanmar.
Identifiers
InChI
InChI=1S/C26H36O9/c1-13(27)33-20-21(34-14(2)28)23(4,5)26(31)10-8-16-18(24(26,6)22(20)35-15(3)29)12-19-17(9-11-32-19)25(16,7)30/h9,11,16,18,20-22,30-31H,8,10,12H2,1-7H3
0 references
InChIKey
DPGQCKFUTIWGSN-UHFFFAOYSA-N
0 references
PubChem CID
162996165
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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