(1R,5Z,8R,10E,12S,13R,15S,16R,17S,18R)-18-benzyl-6,8,15,16-tetramethyl-2,14-dioxa-19-azatetracyclo[10.8.0.0¹,¹⁷.0¹³,¹⁵]icosa-5,10-diene-3,7,20-trione
AlkaPlorer ID: AK571661
Synonym: None
IUPAC Name: (1S,5Z,8S,10Z,12S,13S,15R,16S,17S,18S)-18-benzyl-6,8,15,16-tetramethyl-2,14-dioxa-19-azatetracyclo[10.8.0.01,17.013,15]icosa-5,10-diene-3,7,20-trione
Structure
SMILES: C/C1=C/CC(=O)O[C@@]23C(O)=N[C@@H](CC4=CC=CC=C4)[C@@H]2[C@H](C)[C@@]2(C)O[C@H]2[C@@H]3/C=C\C[C@H](C)C1=O
InChI: InChI=1S/C28H33NO5/c1-16-9-8-12-20-25-27(4,34-25)18(3)23-21(15-19-10-6-5-7-11-19)29-26(32)28(20,23)33-22(30)14-13-17(2)24(16)31/h5-8,10-13,16,18,20-21,23,25H,9,14-15H2,1-4H3,(H,29,32)/b12-8-,17-13-/t16-,18-,20-,21-,23-,25-,27+,28+/m0/s1
InChIKey: XNIXILZHFOBLTQ-XAQVUCBISA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Rosellinia necatrix | Rosellinia | Xylariaceae | Xylariales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 463.5740000000002
TPSA？: 88.49000000000001
MolLogP？: 4.390900000000004
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|