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(Q105112735)
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English
(4a,6-dihydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-5-yl) 3-phenylprop-2-enoate
group of stereoisomers with the chemical formula C₂₉H₃₆O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
cassane diterpenoid
1 reference
inferred from
cassane diterpenoid
mass
464.25627425199986
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₉H₃₆O₅
0 references
canonical SMILES
O=C(OC1C(O)C2C(C=3C=COC3CC2C4(C)CCCC(C)(C)C14O)C)C=CC=5C=CC=CC5
0 references
found in taxon
Alpinia pulcherrima
1 reference
stated in
Antitubercular cassane furanoditerpenoids from the roots of Caesalpinia pulcherrima.
Identifiers
InChI
InChI=1S/C29H36O5/c1-18-20-13-16-33-22(20)17-21-24(18)25(31)26(29(32)27(2,3)14-8-15-28(21,29)4)34-23(30)12-11-19-9-6-5-7-10-19/h5-7,9-13,16,18,21,24-26,31-32H,8,14-15,17H2,1-4H3
0 references
InChIKey
IGNZARMTFKDIDD-UHFFFAOYSA-N
0 references
PubChem CID
78412640
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IGNZARMTFKDIDD-UHFFFAOYSA-N
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