Tuboxenine

AlkaPlorer ID: AK316895

Synonym: 2,20-Cycloaspidospermidine

IUPAC Name: 20-methyl-8,16-diazahexacyclo[10.6.1.19,12.01,9.02,7.016,19]icosa-2,4,6-triene

Structure

SMILES: CC1C23CCCN4CCC5(C6=CC=CC=C6NC15CC2)C43

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InChI: InChI=1S/C19H24N2/c1-13-17-7-4-11-21-12-10-18(16(17)21)14-5-2-3-6-15(14)20-19(13,18)9-8-17/h2-3,5-6,13,16,20H,4,7-12H2,1H3

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InChIKey: ZMNQOAJDBCBZSX-UHFFFAOYSA-N

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Reference

PubChem CID: 14107702

CAS: 26242-59-1

COCONUT: CNP0148479.2

Source

Properties Information

Molecule Weight: 280.4150000000001

TPSA: 15.27

MolLogP: 3.386700000000002

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information