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54781-87-2 | (13aS)-9,11,12,13,13aα,14-Hexahydro-3,6,7-trimethoxydibenzo[f,h]pyrrolo[1,2-b]isoquinoline
CAS No: 54781-87-2 Catalog No: AG00DOKB MDL No:
Product Description
Catalog Number:
AG00DOKB
Chemical Name:
(13aS)-9,11,12,13,13aα,14-Hexahydro-3,6,7-trimethoxydibenzo[f,h]pyrrolo[1,2-b]isoquinoline
CAS Number:
54781-87-2
IUPAC Name:
(13aS)-3,6,7-trimethoxy-9,11,12,13,13a,14-hexahydrophenanthro[9,10-f]indolizine
InChI:
InChI=1S/C23H25NO3/c1-25-15-6-7-16-17-9-14-5-4-8-24(14)13-21(17)20-12-23(27-3)22(26-2)11-19(20)18(16)10-15/h6-7,10-12,14H,4-5,8-9,13H2,1-3H3/t14-/m0/s1
InChI Key:
RFPUTOSCASFEEO-AWEZNQCLSA-N
Properties
Complexity:
528
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
363.183g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
363.457g/mol
Monoisotopic Mass:
363.183g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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