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Cinchonine

Catalog Number
ACM118105
Product Name
Cinchonine
Structure
Cinchonine
CAS
118-10-5
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Description
Cinchonine is a natural compound present in Cinchona bark. Cinchonine activates endoplasmic reticulum stress-induced apoptosis in human liver cancer cells.
Synonyms
(5-Ethenyl-1-azabicyclo[2.2.2]oct-2-yl)(quinolin-4-yl)methanol
IUPAC Name
(S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;
Molecular Weight
294.4
Molecular Formula
C19H22N2O;
InChI
InChI=1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2/t13-,14-,18+,19-/m0/s1
InChI Key
KMPWYEUPVWOPIM-QAMTZSDWSA-N
Melting Point
260-263 °C
Purity
98%+
Appearance
Solid
Storage
Store below +30°C.
Complexity
412
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
4
EC Number
204-234-6
Exact Mass
294.17321333
H-Bond Acceptor
3
H-Bond Donor
1
Heavy Atom Count
22
Isomeric SMILES
C=C[C@H]1CN2CC[C@H]1C[C@@H]2[C@H](C3=CC=NC4=CC=CC=C34)O
Monoisotopic Mass
294.17321333
NSC Number
6176
Physical State
Micro-crystalline powder
Rotatable Bond Count
3
Topological Polar Surface Area
36.4 Ų
UNII
V43X79NZCD
Application
Cinchonine occurs in most varieties of cinchonabark (Cinchona micrantha and Rubiaceae).It is used as an antimalarial agent.
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