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(Q115969407)
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English
N-[17-[1-(dimethylamino)ethyl]-2,4-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]-2-methylbut-2-enamide
group of stereoisomers with the chemical formula C₂₈H₄₆N₂O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
458.350843332
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₈H₄₆N₂O₃
0 references
canonical SMILES
O=C(NC1C(O)CC2(C)C(CCC3C4=CCC(C(N(C)C)C)C4(C)CCC32)C1O)C(=CC)C
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found in taxon
Sarcococca saligna
1 reference
stated in
3D-QSAR studies on natural acetylcholinesterase inhibitors of Sarcococca saligna by comparative molecular field analysis (CoMFA)
Identifiers
InChI
InChI=1S/C28H46N2O3/c1-8-16(2)26(33)29-24-23(31)15-28(5)21-13-14-27(4)19(17(3)30(6)7)11-12-20(27)18(21)9-10-22(28)25(24)32/h8,12,17-19,21-25,31-32H,9-11,13-15H2,1-7H3,(H,29,33)
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InChIKey
QVNOTNUGUHMPDI-UHFFFAOYSA-N
0 references
PubChem CID
75015154
2 references
stated in
PubChem
retrieved
3 January 2023
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QVNOTNUGUHMPDI-UHFFFAOYSA-N
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