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(Q104396076)
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English
6-(5,6-Dimethylheptan-2-yl)-5-methylpentacyclo[11.4.1.01,13.02,10.05,9]octadec-2-en-15-ol
group of stereoisomers with the chemical formula C₂₈H₄₆O
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
398.354866092
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₈H₄₆O
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canonical SMILES
OC1CCC23C4=CCC5(C)C(CCC5C(C)CCC(C)C(C)C)C4CCC3(C1)C2
0 references
found in taxon
Nervilia plicata
2 references
stated in
Structure and C-13 signal assignments of new methylsterols from by two-dimensional NMR spectroscopy
stated in
Isolation and structure of cyclonervilasterol, 24-epicyclonervilasterol, dihydrocyclonervilasterol, and 24-epidihydrocyclonervilasterol. Novel methylsterols from Nervilia purpurea Schlechter.
Identifiers
InChI
InChI=1S/C28H46O/c1-18(2)19(3)6-7-20(4)23-8-9-24-22-11-14-27-16-21(29)10-15-28(27,17-27)25(22)12-13-26(23,24)5/h12,18-24,29H,6-11,13-17H2,1-5H3
0 references
InChIKey
QTDQCYQUOZSSJT-UHFFFAOYSA-N
0 references
PubChem CID
163068224
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QTDQCYQUOZSSJT-UHFFFAOYSA-N
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