(1S,2R,5S,6R,7R)-6-N-(4-chlorophenyl)-3-[(4-chlorophenyl)methyl]-2-N-[(1S,2S,3R)-2,3-dimethylcyclohexyl]-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-2,6-dicarboxamide
AlkaPlorer ID: AK336683
Synonym: None
IUPAC Name: (1S,2R,5S,6R,7R)-6-N-(4-chlorophenyl)-3-[(4-chlorophenyl)methyl]-2-N-[(1S,2S,3R)-2,3-dimethylcyclohexyl]-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-2,6-dicarboxamide
Structure
SMILES: C[C@H]1[C@H](C)CCC[C@@H]1NC(=O)[C@@H]1N(CC2=CC=C(Cl)C=C2)C(=O)[C@H]2[C@@H](C(=O)NC3=CC=C(Cl)C=C3)[C@H]3C=C[C@@]12O3
InChI: InChI=1S/C31H33Cl2N3O4/c1-17-4-3-5-23(18(17)2)35-29(38)27-31-15-14-24(40-31)25(28(37)34-22-12-10-21(33)11-13-22)26(31)30(39)36(27)16-19-6-8-20(32)9-7-19/h6-15,17-18,23-27H,3-5,16H2,1-2H3,(H,34,37)(H,35,38)/t17-,18+,23+,24-,25+,26-,27+,31+/m1/s1
InChIKey: ATJQTGHEYDPPED-DGNDOITESA-N
Reference
Bioactive Benzophenones from <i>Garcinia </i><i>x</i><i>anthochymus </i>Fruits
PubChem CID: 129435024
Source
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Properties Information
Molecule Weight: 582.5280000000001
TPSA？: 87.74000000000001
MolLogP？: 5.223600000000005
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 6
Activities Information
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