Mavacurine

AlkaPlorer ID: AK305334

Synonym: 19,20-Didehydro-17-hydroxy-4-methyl-1,16-cyclocorynanium, C-Mavacurine 

IUPAC Name: [(13E)-13-ethylidene-11-methyl-1-aza-11-azoniapentacyclo[12.3.1.02,7.08,17.011,16]octadeca-2,4,6,8(17)-tetraen-18-yl]methanol

Structure

SMILES: C/C=C1/C[N+]2(C)CCC3=C4C2CC1C(CO)N4C1=CC=CC=C31

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InChI: InChI=1S/C20H25N2O/c1-3-13-11-22(2)9-8-15-14-6-4-5-7-17(14)21-18(12-23)16(13)10-19(22)20(15)21/h3-7,16,18-19,23H,8-12H2,1-2H3/q+1/b13-3-

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InChIKey: HFLUPWJGJPYITM-DXNYSGJVSA-N

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Properties Information

Molecule Weight: 309.433

TPSA: 25.16

MolLogP: 3.198300000000001

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information