1-[6-[[(13S,17S)-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]amino]hexyl]pyrrolidine-2,5-dione


Chemical Name: 1-[6-[[(13S,17S)-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]amino]hexyl]pyrrolidine-2,5-dione
CAS Number: 142878-12-4
Product Number: AG007KKR(AGN-PC-015JWD)
Synonyms:
MDL No: MFCD00211221
Molecular Formula: C29H42N2O3
Molecular Weight: 466.6554

Identification/Properties


Computed Properties
Molecular Weight:
466.666g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
9
Exact Mass:
466.32g/mol
Monoisotopic Mass:
466.32g/mol
Topological Polar Surface Area:
58.6A^2
Heavy Atom Count:
34
Formal Charge:
0
Complexity:
725
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
5
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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