Consabatine
AlkaPlorer ID: AK000286
Synonym: None
IUPAC Name: [(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 1-hydroxy-3-(3-methylbut-2-enyl)-4-oxocyclohex-2-ene-1-carboxylate
Structure
SMILES: CC(=CCC1=CC(CCC1=O)(C(=O)OC2C[C@H]3CC[C@@H](C2)N3C)O)C
InChI: InChI=1S/C20H29NO4/c1-13(2)4-5-14-12-20(24,9-8-18(14)22)19(23)25-17-10-15-6-7-16(11-17)21(15)3/h4,12,15-17,24H,5-11H2,1-3H3/t15-,16+,17?,20?
InChIKey: JMHTUVBKARXGPJ-HLVUACMISA-N
Reference
PubChem CID: 91751196
Source
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Properties Information
Molecule Weight: 347.4550000000001
TPSA？: 66.84
MolLogP？: 2.5315000000000003
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 3
Activities Information
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