(1R,5S,6S,9S,12S,13R)-6,7,13-trimethyl-7-azapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icosa-2,14,17-trien-16-one
AlkaPlorer ID: AK137120
Synonym: None
IUPAC Name: (1R,5S,6S,9S,12S,13R)-6,7,13-trimethyl-7-azapentacyclo[10.8.0.02,9.05,9.013,18]icosa-2,14,17-trien-16-one
Structure
SMILES: C[C@H]1[C@H]2CC=C3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@H]4CC[C@@]32CN1C
InChI: InChI=1S/C22H29NO/c1-14-18-6-7-20-17-5-4-15-12-16(24)8-10-21(15,2)19(17)9-11-22(18,20)13-23(14)3/h7-8,10,12,14,17-19H,4-6,9,11,13H2,1-3H3/t14-,17+,18+,19-,21-,22-/m0/s1
InChIKey: BAJWHHVEJZLQNO-IZSGYEDXSA-N
Source
Properties Information
Molecule Weight: 323.48000000000013
TPSA？: 20.31
MolLogP？: 4.144600000000003
Number of H-Donors: 0
Number of H-Acceptors: 2
RingCount: 5
Activities Information
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