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(Q105314730)
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English
2-[2-(7-hydroxy-4a-methyl-4-oxo-5,6,7,8-tetrahydro-1aH-naphtho[1,8a-b]oxiren-3-yl)-1-methyl-5-(6-methyl-5-methylideneheptan-2-yl)cyclopentyl]acetaldehyde
group of stereoisomers with the chemical formula C₂₈H₄₂O₄
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Statements
instance of
group of stereoisomers
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subclass of
9,11-secoergostane steroid
1 reference
inferred from
9,11-secoergostane steroid
mass
442.308309824
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₈H₄₂O₄
0 references
canonical SMILES
O=CCC1(C)C(C2=CC3OC43CC(O)CCC4(C2=O)C)CCC1C(C)CCC(=C)C(C)C
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Identifiers
InChI
InChI=1S/C28H42O4/c1-17(2)18(3)7-8-19(4)22-9-10-23(26(22,5)13-14-29)21-15-24-28(32-24)16-20(30)11-12-27(28,6)25(21)31/h14-15,17,19-20,22-24,30H,3,7-13,16H2,1-2,4-6H3
0 references
InChIKey
WXLRMCWJGIIWNT-UHFFFAOYSA-N
0 references
PubChem CID
85209192
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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