1-{[(2R,4R)-1-[(2E,4S,5R,6Z)-6-amino-5-methylnona-2,6-dien-4-yl]-4-methylpiperidin-2-yl]oxy}heptan-2-one
AlkaPlorer ID: AK116660
Synonym: None
IUPAC Name: 1-[(2R,4R)-1-[(2E,4S,5R,6Z)-6-amino-5-methylnona-2,6-dien-4-yl]-4-methylpiperidin-2-yl]oxyheptan-2-one
Structure
SMILES: C/C=C/[C@@H]([C@@H](C)/C(N)=C/CC)N1CC[C@@H](C)C[C@H]1OCC(=O)CCCCC
InChI: InChI=1S/C23H42N2O2/c1-6-9-10-13-20(26)17-27-23-16-18(4)14-15-25(23)22(12-8-3)19(5)21(24)11-7-2/h8,11-12,18-19,22-23H,6-7,9-10,13-17,24H2,1-5H3/b12-8+,21-11-/t18-,19+,22+,23-/m1/s1
InChIKey: PKPUAGZHIXNKMQ-LPBOUMCOSA-N
Reference
Xanthothone, a new nematicidal N-compound from Coprinus xanthothrix
PubChem CID: 162990646
LOTUS: LTS0019069
SuperNatural Ⅲ: SN0287945-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Coprinellus xanthothrix | Coprinellus | Psathyrellaceae | Agaricales | Agaricomycetes | Basidiomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 378.6010000000003
TPSA？: 55.56
MolLogP？: 5.043800000000005
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|