(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-triene-4,8,16-trione
AlkaPlorer ID: AK091500
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-triene-4,8,16-trione
Structure
SMILES: C[C@H]1[C@H]2C(=O)C=C3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@H]4CC[C@@]32C(=O)N1C
InChI: InChI=1S/C22H25NO3/c1-12-19-18(25)11-17-15-5-4-13-10-14(24)6-8-21(13,2)16(15)7-9-22(17,19)20(26)23(12)3/h6,8,10-12,15-16,19H,4-5,7,9H2,1-3H3/t12-,15+,16-,19-,21-,22+/m0/s1
InChIKey: SDZYQQIPDOLYGT-GVUUNMLASA-N
Source
Properties Information
Molecule Weight: 351.44600000000014
TPSA？: 54.45
MolLogP？: 2.850200000000001
Number of H-Donors: 0
Number of H-Acceptors: 3
RingCount: 5
Activities Information
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