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(Q105122132)
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English
17-(5,6-Dimethylheptan-2-yl)-10,13-dimethyl-4-methylidene-1,2,3,5,6,7,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,7-diol
group of stereoisomers with the chemical formula C₂₉H₄₈O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
4-methylergostane steroid
1 reference
inferred from
4-methylergostane steroid
mass
428.365430776
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₉H₄₈O₂
0 references
canonical SMILES
OC1C(=C)C2CC(O)C3=C4CCC(C(C)CCC(C)C(C)C)C4(C)CCC3C2(C)CC1
0 references
found in taxon
Theonella swinhoei
1 reference
stated in
4-Methylenesterols from Theonella swinhoei sponge are natural pregnane-X-receptor agonists and farnesoid-X-receptor antagonists that modulate innate immunity
Identifiers
InChI
InChI=1S/C29H48O2/c1-17(2)18(3)8-9-19(4)21-10-11-22-27-23(12-14-28(21,22)6)29(7)15-13-25(30)20(5)24(29)16-26(27)31/h17-19,21,23-26,30-31H,5,8-16H2,1-4,6-7H3
0 references
InChIKey
IXFWZPANSJAULJ-UHFFFAOYSA-N
0 references
PubChem CID
73810128
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IXFWZPANSJAULJ-UHFFFAOYSA-N
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