(1S,2R,5S,6S,7R)-2-N-cyclohexyl-6-N-(3,4-dimethylphenyl)-4-oxo-3-propyl-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-2,6-dicarboxamide
AlkaPlorer ID: AK332956
Synonym: None
IUPAC Name: (1S,2R,5S,6S,7R)-2-N-cyclohexyl-6-N-(3,4-dimethylphenyl)-4-oxo-3-propyl-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-2,6-dicarboxamide
Structure
SMILES: CCCN1C(=O)[C@H]2[C@H](C(=O)NC3=CC=C(C)C(C)=C3)[C@H]3C=C[C@@]2(O3)[C@@H]1C(=O)NC1CCCCC1
InChI: InChI=1S/C27H35N3O4/c1-4-14-30-23(25(32)28-18-8-6-5-7-9-18)27-13-12-20(34-27)21(22(27)26(30)33)24(31)29-19-11-10-16(2)17(3)15-19/h10-13,15,18,20-23H,4-9,14H2,1-3H3,(H,28,32)(H,29,31)/t20-,21-,22-,23+,27+/m1/s1
InChIKey: AKPPFGBPLMGQJX-VJOZHJGUSA-N
Reference
Bioactive Diterpenes from <i>Orthosiphon labiatus</i> and <i>Salvia africana-lutea</i>
PubChem CID: 100620718
Source
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Properties Information
Molecule Weight: 465.5940000000003
TPSA？: 87.74000000000001
MolLogP？: 3.251440000000001
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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