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144367-16-8

144367-16-8 | 1,2,6,7,8-Indolizinepentol, octahydro-, (1S,2R,6R,7R,8S,8aS)-

CAS No: 144367-16-8 Catalog No: AG001JFA MDL No:

Product Description

Catalog Number:
AG001JFA
Chemical Name:
1,2,6,7,8-Indolizinepentol, octahydro-, (1S,2R,6R,7R,8S,8aS)-
CAS Number:
144367-16-8
Molecular Formula:
C8H15NO5
Molecular Weight:
205.2084
IUPAC Name:
(1S,2R,6R,7R,8S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,2,6,7,8-pentol
InChI:
InChI=1S/C8H15NO5/c10-3-1-9-2-4(11)7(13)8(14)5(9)6(3)12/h3-8,10-14H,1-2H2/t3-,4-,5+,6-,7-,8+/m1/s1
InChI Key:
KSWHMQGAWBUNLD-RDULZCEMSA-N
SMILES:
O[C@@H]1CN2C[C@H]([C@H]([C@H]2[C@@H]([C@@H]1O)O)O)O

Properties

Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
6  
Defined Bond Stereocenter Count:
0
Exact Mass:
205.095g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
205.21g/mol
Monoisotopic Mass:
205.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.2  

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