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(Q105001438)
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English
brussonol
chemical compound
(-)-brussonol
abrotandiol
przewalskin E hydroquinone
(1S,9S,11S)-6-isopropyl-12,12-dimethyl-16-oxatetracyclo[7.6.1.0¹,¹¹.0³,⁸]hexadeca-3(8),4,6-triene-4,5-diol
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Statements
instance of
type of chemical entity
0 references
subclass of
isetexane diterpenoids
0 references
chemical structure
Brussonol.svg
525 × 365; 14 KB
0 references
mass
316.203844756
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(10R)-9,10-Seco-9,20-cyclo-7alpha,10-epoxyabieta-8,11,13-triene-11,12-diol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₂₈O₃
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canonical SMILES
OC=1C(O)=C(C=C2C1CC34OC2CC3C(C)(C)CCC4)C(C)C
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isomeric SMILES
CC(C)c1cc2c(c(O)c1O)C[C@@]13CCCC(C)(C)[C@@H]1C[C@@H]2O3
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found in taxon
Salvia broussonetii
1 reference
stated in
Diterpenes from Salvia broussonetii transformed roots and their insecticidal activity
Identifiers
InChI
InChI=1S/C20H28O3/c1-11(2)12-8-13-14(18(22)17(12)21)10-20-7-5-6-19(3,4)16(20)9-15(13)23-20/h8,11,15-16,21-22H,5-7,9-10H2,1-4H3/t15-,16-,20-/m0/s1
0 references
InChIKey
FTWYPGDUWLQFCC-FTRWYGJKSA-N
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CAS Registry Number
860018-56-0
1 reference
stated in
SciFinder
PubChem CID
76311952
1 reference
matched by identifier from
InChIKey
InChIKey
FTWYPGDUWLQFCC-FTRWYGJKSA-N
UniChem compound ID
79976356
1 reference
stated in
UniChem
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