(1R,2S,5S,6S,9R,12S,13R,16S)-N,6,13-trimethyl-7-azapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icos-18-en-16-amine

AlkaPlorer ID: AK101481

Synonym: None

IUPAC Name: (5S,9R,13R,16S)-N,6,13-trimethyl-7-azapentacyclo[10.8.0.02,9.05,9.013,18]icos-18-en-16-amine

Structure

SMILES: CN[C@H]1CC[C@@]2(C)C(=CCC3C4CC[C@@H]5C(C)NC[C@]45CCC32)C1

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InChI: InChI=1S/C22H36N2/c1-14-18-6-7-20-17-5-4-15-12-16(23-3)8-10-21(15,2)19(17)9-11-22(18,20)13-24-14/h4,14,16-20,23-24H,5-13H2,1-3H3/t14?,16-,17?,18+,19?,20?,21-,22-/m0/s1

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InChIKey: SHCHXCXYUPHKHW-XYCJAUNVSA-N

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Reference

PubChem CID: 5316046

NPASS: NPC274505

Properties Information

Molecule Weight: 328.5440000000001

TPSA: 24.06

MolLogP: 4.125200000000003

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information