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(Q110198627)
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English
5-Hydroxy-5-methyl-3-[2,6,13-trihydroxy-13-[5-(1-hydroxytridecyl)oxolan-2-yl]-8-oxotridecyl]furan-2-one
group of stereoisomers with the chemical formula C₃₅H₆₂O₉
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
626.439383564
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₅H₆₂O₉
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canonical SMILES
O=C1OC(O)(C=C1CC(O)CCCC(O)CC(=O)CCCCC(O)C2OC(CC2)C(O)CCCCCCCCCCCC)C
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found in taxon
Annona montana
1 reference
stated in
Cytotoxic mono-tetrahydrofuran ring acetogenins from leaves of Annona montana
Annona muricata
1 reference
stated in
MALDI-TOF MS profiling of annonaceous acetogenins in Annona muricata products for human consumption
Identifiers
InChI
InChI=1S/C35H62O9/c1-3-4-5-6-7-8-9-10-11-12-19-30(39)32-21-22-33(43-32)31(40)20-14-13-16-28(37)24-29(38)18-15-17-27(36)23-26-25-35(2,42)44-34(26)41/h25,27,29-33,36,38-40,42H,3-24H2,1-2H3
0 references
InChIKey
STJJUSLIASGPDV-UHFFFAOYSA-N
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PubChem CID
85124391
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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