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79733-05-4

79733-05-4 | dl-2-(1-Methyl-2-pyrrolidinyl)pyridine

CAS No: 79733-05-4 Catalog No: AG00GQ5O MDL No:

Product Description

Catalog Number:
AG00GQ5O
Chemical Name:
dl-2-(1-Methyl-2-pyrrolidinyl)pyridine
CAS Number:
79733-05-4
IUPAC Name:
(9R,10S,13S,14R,16S,18R)-4-bromo-13-ethyl-15-hexyl-8-methyl-8-aza-15-azoniahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2(7),3,5-triene-14,18-diol;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate
InChI:
InChI=1S/C26H38BrN2O2.C4H6O6/c1-4-6-7-8-11-29-20-13-17(16(5-2)25(29)31)22-21(29)14-26(24(22)30)18-12-15(27)9-10-19(18)28(3)23(20)26;5-1(3(7)8)2(6)4(9)10/h9-10,12,16-17,20-25,30-31H,4-8,11,13-14H2,1-3H3;1-2,5-6H,(H,7,8)(H,9,10)/q+1;/p-1/t16-,17?,20-,21-,22?,23-,24+,25+,26?,29?;1-,2-/m01/s1
InChI Key:
GOSBILILBHLETE-RZJHXRLLSA-M

Properties

Complexity:
868  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
8  
Defined Bond Stereocenter Count:
0
Exact Mass:
638.22g/mol
Formal Charge:
0
Heavy Atom Count:
41  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
639.584g/mol
Monoisotopic Mass:
638.22g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
162A^2
Undefined Atom Stereocenter Count:
4  
Undefined Bond Stereocenter Count:
0

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