tert-butyl 2-oxo-18-azatetracyclo[9.7.0.0³,⁸.0¹²,¹⁷]octadeca-1(11),3,5,7,12,14,16-heptaene-18-carboxylate
AlkaPlorer ID: AK081996
Synonym: None
IUPAC Name: tert-butyl 2-oxo-18-azatetracyclo[9.7.0.03,8.012,17]octadeca-1(11),3,5,7,12,14,16-heptaene-18-carboxylate
Structure
SMILES: CC(C)(C)OC(=O)N1C2=C(CCC3=CC=CC=C3C2=O)C2=CC=CC=C21
InChI: InChI=1S/C22H21NO3/c1-22(2,3)26-21(25)23-18-11-7-6-10-16(18)17-13-12-14-8-4-5-9-15(14)20(24)19(17)23/h4-11H,12-13H2,1-3H3
InChIKey: BFGCHSCZKGYCOF-UHFFFAOYSA-N
Reference
Oppositines A and B, Sesquiterpene Pyridine Alkaloids from a Sri Lankan <i>Pleurostylia opposita</i>
PubChem CID: 45934551
SuperNatural Ⅲ: SN0023905
COCONUT: CNP0069340
Source
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Properties Information
Molecule Weight: 347.41400000000004
TPSA？: 48.3
MolLogP？: 4.754100000000005
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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