Coronaridine
AlkaPlorer ID: AK023477
Synonym: '', '(-)-Coronaridine', 'coronaridine', 'MLSMR', 'Coronaridine', 'MLS000728617', 'SMR000470797', 'Coronaridine HCl'
IUPAC Name: methyl (1R,15R,17S,18S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate
Structure
SMILES: CC[C@H]1C[C@H]2CN3CCC4=C(NC5=CC=CC=C45)[C@@](C(=O)OC)(C2)[C@H]13
InChI: InChI=1S/C21H26N2O2/c1-3-14-10-13-11-21(20(24)25-2)18-16(8-9-23(12-13)19(14)21)15-6-4-5-7-17(15)22-18/h4-7,13-14,19,22H,3,8-12H2,1-2H3/t13-,14+,19+,21+/m1/s1
InChIKey: NVVDQMVGALBDGE-PKOZFGMGSA-N
Source
Properties Information
Molecule Weight: 338.45100000000014
TPSA？: 45.33
MolLogP？: 3.255200000000002
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 6
Activities Information
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