3-hydroxyquinine
Chemical Formula:
C20H25N2O3
Molecular Weight:
341.429 Daltons
Monoisotopic Mass:
341.1865176792 Daltons
SMILES:
C=CC1(O)(C2(CC[N+](C1)[CH](C2)C(O)C3(=CC=NC4(=CC=C(OC)C=C34))))
InChI:
1S/C20H24N2O3/c1-3-20(24)12-22-9-7-13(20)10-18(22)19(23)15-6-8-21-17-5-4-14(25-2)11-16(15)17/h3-6,8,11,13,18-19,23-24H,1,7,9-10,12H2,2H3/p+1/t13-,18-,19+,20+/m0/s1
InChIKey:
Databases
MetaCyc:
3-HYDROXYQUININE
ChEBI:
58234
PubChem (CID):
49852304
HMDB:
HMDB01091
KEGG:
C07344
Seed:
cpd04547
MetaNetX:
MNXM3845