5H,14H-Pyrrolo[1'',2'':4',5']pyrazino[1',2':1,6]pyrido[3,4-b]indole-5,14-dione,1,2,3,5a,6,11,12,14a-octahydro-9-methoxy-12-(2-methyl-1-propenyl)-,(5aS,12S,14aS)-


Chemical Name: 5H,14H-Pyrrolo[1'',2'':4',5']pyrazino[1',2':1,6]pyrido[3,4-b]indole-5,14-dione,1,2,3,5a,6,11,12,14a-octahydro-9-methoxy-12-(2-methyl-1-propenyl)-,(5aS,12S,14aS)-
CAS Number: 118974-02-0
Product Number: AG008Y1Y(AGN-PC-0PCPL0)
Synonyms:
MDL No: MFCD08702652
Molecular Formula: C22H25N3O3
Molecular Weight: 379.4522

Identification/Properties


Computed Properties
Molecular Weight:
379.46g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
379.19g/mol
Monoisotopic Mass:
379.19g/mol
Topological Polar Surface Area:
65.6A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
703
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
3
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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