Munroniamide
AlkaPlorer ID: AK071375
Synonym: None
IUPAC Name: [(1R,3S,5R,7R,8R,9R,10R,15R)-15-[(3R)-2,2-dimethyl-5-oxooxolan-3-yl]-7-[1-(3-hydrazinylpropanoyl)-5-oxo-2H-pyrrol-4-yl]-8,15-dimethyl-2-methylidene-12-oxo-4,11-dioxatetracyclo[8.5.0.03,5.03,8]pentadec-13-en-9-yl] acetate
Structure
SMILES: C=C1[C@@H]2[C@@H](OC(=O)C=C[C@@]2(C)[C@H]2CC(=O)OC2(C)C)[C@H](OC(C)=O)[C@@]2(C)[C@H](C3=CCN(C(=O)CCNN)C3=O)C[C@H]3O[C@]132
InChI: InChI=1S/C31H39N3O9/c1-15-24-25(41-22(37)7-10-29(24,5)19-14-23(38)43-28(19,3)4)26(40-16(2)35)30(6)18(13-20-31(15,30)42-20)17-9-12-34(27(17)39)21(36)8-11-33-32/h7,9-10,18-20,24-26,33H,1,8,11-14,32H2,2-6H3/t18-,19-,20+,24+,25+,26-,29-,30+,31+/m0/s1
InChIKey: USEFZMBCGFCDMO-PNBNEUEUSA-N
Reference
Insect Antifeedants from <i>Munronia henryi</i>: Structure of Munroniamide
PubChem CID: 76323175
LOTUS: LTS0105497
SuperNatural Ⅲ: SN0378697-01
NPASS: NPC176245
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Comactinia meridionalis | Comactinia | Comatulidae | Comatulida | Crinoidea | Echinodermata | Metazoa | Eukaryota |
| Limonia acidissima | Limonia | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 597.6650000000002
TPSA？: 166.86
MolLogP？: 1.2461000000000035
Number of H-Donors: 2
Number of H-Acceptors: 11
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Pieris brassicae | Pieris brassicae | Activity | 27.6 | % | 10.1021/jf030292y |
| Pieris brassicae | Pieris brassicae | mortality | 10.0 | % | 10.1021/jf030292y |