CINCHONINE, compd. with MANDELIC ACID
Molecular Formula:
C27H30N2O4
InChI: InChI=1/C19H22N2O.C8H8O3/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;9-7(8(10)11)6-4-2-1-3-5-6/h2-7,9,13-14,18-19,22H,1,8,10-12H2;1-5,7,9H,(H,10,11)/fC19H23N2O.C8H7O3/h21H;/q+1;-1
InChIKey: InChIKey=XBTKTVWGGJAGRB-RWMSDDCJCH
SMILES: C=CC1C[NH+]2CCC1CC2C(C3=CC=NC4=CC=CC=C34)O.C1=CC=C(C=C1)C(C(=O)[O-])O
Names:
Cinchonan-9-ol, (9S)-, mono(alpha-hydroxybenzeneacetate) (salt)
CINCHONINE, compd. with MANDELIC ACID
(5-ethenyl-1-azoniabicyclo[2.2.2]oct-7-yl)-quinolin-4-yl-methanol; 2-hydroxy-2-phenyl-acetate
69470-37-7
Registries:
PubChem CID 50575
PubChem ID 189005
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