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cinchonine

MNXM46804 is deprecated and here replaced by MNXM1371771
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1371771 Image of MNXM1371771
referencemetacycM:CPD-9847
formulaC19H23N2O
global charge1
mol weight295.406
InChIKeyKMPWYEUPVWOPIM-OHHBCXFOSA-O
InChIInChI=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/p+1/t13-,14-,18-,19+/m1/s1
SMILESC=C[C@@H]1C[NH+]2CC[C@@H]1C[C@@H]2[C@@H](O)C1=CC=NC2=CC=CC=C21
MNX internals
InChI (mnx)InChI=1/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+/m1/s1 Image of MNXM1371771
SMILES (mnx)[CH2:1]=[CH:2][C@@H:13]1[CH2:12][N:21]2[CH2:10][CH2:8][C@@H:14]1[CH2:11][C@@H:18]2[C@H:19]([C:16]1=[CH:7][CH:9]=[N:20][C:17]2=[CH:6][CH:4]=[CH:3][CH:5]=[C:15]12)[OH:22]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-9847
metacycM:CPD-9847
KMPWYEUPVWOPIM-OHHBCXFOSA-O 		cinchonine