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(Q105034827)
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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-methylheptan-2-yl)cyclopentyl]acetaldehyde
group of stereoisomers with the chemical formula C₂₇H₄₂O₄
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Statements
instance of
group of stereoisomers
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subclass of
9,11-secocholestane steroid
1 reference
inferred from
9,11-secocholestane steroid
mass
430.308309824
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₇H₄₂O₄
0 references
canonical SMILES
O=CCC1(C)C(C2=CC3OC43CC(O)CCC4(C2=O)C)CCC1C(C)CCCC(C)C
0 references
Identifiers
InChI
InChI=1S/C27H42O4/c1-17(2)7-6-8-18(3)21-9-10-22(25(21,4)13-14-28)20-15-23-27(31-23)16-19(29)11-12-26(27,5)24(20)30/h14-15,17-19,21-23,29H,6-13,16H2,1-5H3
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InChIKey
HWTUUAJZGNFIHU-UHFFFAOYSA-N
0 references
PubChem CID
162937100
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HWTUUAJZGNFIHU-UHFFFAOYSA-N
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