Halovir E
AlkaPlorer ID: AK047102
Synonym: None
IUPAC Name: 2-[[(2S)-2-[[2-[[(2S)-1-[2-(dodecanoylamino)-2-methylpropanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-N-[(2S)-1-hydroxy-4-methylpentan-2-yl]pentanediamide
Structure
SMILES: CCCCCCCCCCCC(O)=NC(C)(C)C(=O)N1CCC[C@H]1C(O)=NC(CC(C)C)C(O)=N[C@H](C(O)=NC(CCC(=N)O)C(O)=N[C@H](CO)CC(C)C)C(C)C
InChI: InChI=1S/C43H79N7O8/c1-10-11-12-13-14-15-16-17-18-21-36(53)49-43(8,9)42(58)50-24-19-20-34(50)40(56)47-33(26-29(4)5)39(55)48-37(30(6)7)41(57)46-32(22-23-35(44)52)38(54)45-31(27-51)25-28(2)3/h28-34,37,51H,10-27H2,1-9H3,(H2,44,52)(H,45,54)(H,46,57)(H,47,56)(H,48,55)(H,49,53)/t31-,32?,33?,34-,37-/m0/s1
InChIKey: VIMHZRMCYGNNPY-WBMKAPEISA-N
Reference
Halovirs A–E, new antiviral agents from a marine-Derived fungus of the genus Scytalidium
PubChem CID: 21777388
LOTUS: LTS0067444
{NPAtlas: NPA009353
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Scytalidium sp. | Scytalidium | None | None | Leotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 822.146
TPSA？: 247.57
MolLogP？: 8.989770000000002
Number of H-Donors: 8
Number of H-Acceptors: 8
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|