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(Q105194682)
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English
4-O-[5-hydroxy-7,11-dimethyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecan-14-yl] 1-O-methyl butanedioate
group of stereoisomers with the chemical formula C₂₉H₃₈O₈
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Statements
instance of
group of stereoisomers
0 references
subclass of
bufanolide
1 reference
inferred from
bufanolide
mass
514.256668176
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₉H₃₈O₈
0 references
canonical SMILES
O=C1OC=C(C=C1)C2C(O)C3OC34C5CCC6CC(OC(=O)CCC(=O)OC)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/C29H38O8/c1-27-12-10-18(36-23(32)9-8-21(30)34-3)14-17(27)5-6-20-19(27)11-13-28(2)24(16-4-7-22(31)35-15-16)25(33)26-29(20,28)37-26/h4,7,15,17-20,24-26,33H,5-6,8-14H2,1-3H3
0 references
InChIKey
ONGYSNZKOXRFQH-UHFFFAOYSA-N
0 references
PubChem CID
163066395
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ONGYSNZKOXRFQH-UHFFFAOYSA-N
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