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Hydrocinchonine

Catalog Number
ACM485654
Product Name
Hydrocinchonine
Structure
Hydrocinchonine
CAS
485-65-4
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Synonyms
(1S)-((2R,4S,5R)-5-Ethylquinuclidin-2-yl)(quinolin-4-yl)methanol; Dihydrocinchonine; AK112137; AJ-64432; ZINC13826669; AC-30195; (9S)-10,11-Dihydrocinchonan-9-ol; Hydrocinchonine, >=95.0% (sum of enantiomers, HPLC); ZPF9J31NM8; SCHEMBL192607;
IUPAC Name
(S)-[(2R,4S,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;
Molecular Weight
296.414g/mol
Molecular Formula
C19H24N2O;
Canonical SMILES
CCC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)O;
InChI
InChI=1S/C19H24N2O/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/h3-7,9,13-14,18-19,22H,2,8,10-12H2,1H3/t13-,14-,18+,19-/m0/s1;
InChI Key
WFJNHVWTKZUUTR-QAMTZSDWSA-N;
Complexity
388
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
4
EC Number
207-621-8
Exact Mass
296.189g/mol
H-Bond Acceptor
3
H-Bond Donor
1
Heavy Atom Count
22
Monoisotopic Mass
296.189g/mol
Rotatable Bond Count
3
Topological Polar Surface Area
36.4A^2
UNII
ZPF9J31NM8
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