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(Q105254659)
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English
(1,3-Diacetyloxy-4a-hydroxy-4,4,11b-trimethyl-7-oxo-1,2,3,5,6,6a,11,11a-octahydronaphtho[2,1-f][1]benzofuran-2-yl) acetate
group of stereoisomers with the chemical formula C₂₅H₃₂O₉
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Statements
instance of
group of stereoisomers
0 references
subclass of
drimane sesquiterpenoid
1 reference
inferred from
drimane sesquiterpenoid
mass
476.204632604
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₃₂O₉
0 references
canonical SMILES
O=C(OC1C(OC(=O)C)C(C)(C)C2(O)CCC3C(=O)C=4C=COC4CC3C2(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/C25H32O9/c1-12(26)32-20-21(33-13(2)27)23(4,5)25(30)9-7-15-17(24(25,6)22(20)34-14(3)28)11-18-16(19(15)29)8-10-31-18/h8,10,15,17,20-22,30H,7,9,11H2,1-6H3
0 references
InChIKey
SJZIFWGVHGVKAH-UHFFFAOYSA-N
0 references
PubChem CID
72768374
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SJZIFWGVHGVKAH-UHFFFAOYSA-N
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