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English
calotropin
group of stereoisomers with the chemical formula C₂₉H₄₀O₉
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Statements
instance of
group of stereoisomers
0 references
subclass of
cardanolides
1 reference
inferred from
cardanolides
mass
532.26723286
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₉H₄₀O₉
0 references
canonical SMILES
O=CC12CC3OC4(O)C(OC(C)CC4O)OC3CC2CCC5C1CCC6(C)C(C7=CC(=O)OC7)CCC56O
0 references
found in taxon
Calotropis procera
1 reference
stated in
Zusammenhänge zwischen den wichtigsten Giftstoffen der Calotropis procera V. Mitteilung über afrikanische Pfeilgifte
Aria edulis
1 reference
stated in
Ghalakinoside, a cytotoxic cardiac glycoside from Pergularia tomentosa
Identifiers
InChI
InChI=1S/C29H40O9/c1-15-9-23(31)29(34)25(36-15)37-21-11-17-3-4-20-19(27(17,14-30)12-22(21)38-29)5-7-26(2)18(6-8-28(20,26)33)16-10-24(32)35-13-16/h10,14-15,17-23,25,31,33-34H,3-9,11-13H2,1-2H3
0 references
InChIKey
OWPWFVVPBYFKBG-UHFFFAOYSA-N
0 references
PubChem CID
30100
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OWPWFVVPBYFKBG-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL868548
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OWPWFVVPBYFKBG-UHFFFAOYSA-N
UniChem compound ID
68841325
1 reference
stated in
UniChem
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