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(Q105377410)
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English
4-[[5-Hydroxy-7,11-dimethyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecan-14-yl]oxy]-4-oxobutanoic acid
group of stereoisomers with the chemical formula C₂₈H₃₆O₈
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Statements
instance of
group of stereoisomers
0 references
subclass of
bufanolide
1 reference
inferred from
bufanolide
mass
500.241018112
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₈H₃₆O₈
0 references
canonical SMILES
O=C1OC=C(C=C1)C2C(O)C3OC34C5CCC6CC(OC(=O)CCC(=O)O)CCC6(C)C5CCC24C
0 references
found in taxon
Common toad
1 reference
stated in
Isolation and characterization of cinobufagin 3-glutaroyl-L-arginine ester from Bufo bufo gargarizans Cantor.
Asiatic toad
1 reference
stated in
Isolation and characterization of cinobufagin 3-glutaroyl-L-arginine ester from Bufo bufo gargarizans Cantor.
Identifiers
InChI
InChI=1S/C28H36O8/c1-26-11-9-17(35-22(32)8-6-20(29)30)13-16(26)4-5-19-18(26)10-12-27(2)23(15-3-7-21(31)34-14-15)24(33)25-28(19,27)36-25/h3,7,14,16-19,23-25,33H,4-6,8-13H2,1-2H3,(H,29,30)
0 references
InChIKey
ZIQZTJFREABBOO-UHFFFAOYSA-N
0 references
PubChem CID
162905119
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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