Merresectine A
AlkaPlorer ID: AK005140
Synonym: None
IUPAC Name: [(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl] 3-methoxybenzoate
Structure
SMILES: COC1=CC=CC(=C1)C(=O)OC2C[C@H]3CC[C@@H](C2)N3
InChI: InChI=1S/C15H19NO3/c1-18-13-4-2-3-10(7-13)15(17)19-14-8-11-5-6-12(9-14)16-11/h2-4,7,11-12,14,16H,5-6,8-9H2,1H3/t11-,12+,14?
InChIKey: GWVGSKHNJYDCEQ-ONXXMXGDSA-N
Reference
PubChem CID: 11276989
Source
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Properties Information
Molecule Weight: 261.3209999999999
TPSA？: 47.56
MolLogP？: 2.135
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 3
Activities Information
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