(3R,6S,9S,13R)-9-benzyl-13-hexyl-6-methyl-3-(2-methylpropyl)-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone
AlkaPlorer ID: AK127233
Synonym: None
IUPAC Name: (3R,6S,9S,13R)-9-benzyl-13-hexyl-6-methyl-3-(2-methylpropyl)-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone
Structure
SMILES: CCCCCC[C@@H]1CC(O)=N[C@@H](CC2=CC=CC=C2)C(O)=N[C@@H](C)C(O)=N[C@H](CC(C)C)C(=O)O1
InChI: InChI=1S/C27H41N3O5/c1-5-6-7-11-14-21-17-24(31)29-22(16-20-12-9-8-10-13-20)26(33)28-19(4)25(32)30-23(15-18(2)3)27(34)35-21/h8-10,12-13,18-19,21-23H,5-7,11,14-17H2,1-4H3,(H,28,33)(H,29,31)(H,30,32)/t19-,21+,22-,23+/m0/s1
InChIKey: YUJXCNCSPRKCFX-FCJDFRRUSA-N
Reference
Revised structure of beauvellide a cyclodepsipeptide from Beauveria tenella
PubChem CID: 101316891
LOTUS: LTS0097259
SuperNatural Ⅲ: SN0460549-02
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Beauveria tenella | Beauveria | Cordycipitaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 487.6410000000003
TPSA？: 124.07
MolLogP？: 5.556300000000005
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|