(3s,6r,9s,12s,19s)-5,8,11,14,17-pentahydroxy-3,9-diisopropyl-12-methyl-6-(2-methylpropyl)-19-nonyl-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one
AlkaPlorer ID: AK007037
Synonym: '(3S,6R,9S,12S,19S)-5,8,11,14,17-pentahydroxy-12-methyl-6-(2-methylpropyl)-19-nonyl-3,9-bis(propan-2-yl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one'
IUPAC Name: (3S,6R,9S,12S,19S)-12-methyl-6-(2-methylpropyl)-19-nonyl-3,9-di(propan-2-yl)-1-oxa-4,7,10,13,16-pentazacyclononadecane-2,5,8,11,14,17-hexone
Structure
SMILES: CCCCCCCCC[C@H]1CC(O)=NCC(O)=N[C@@H](C)C(O)=N[C@@H](C(C)C)C(O)=N[C@H](CC(C)C)C(O)=N[C@@H](C(C)C)C(=O)O1
InChI: InChI=1S/C33H59N5O7/c1-9-10-11-12-13-14-15-16-24-18-26(39)34-19-27(40)35-23(8)30(41)37-28(21(4)5)32(43)36-25(17-20(2)3)31(42)38-29(22(6)7)33(44)45-24/h20-25,28-29H,9-19H2,1-8H3,(H,34,39)(H,35,40)(H,36,43)(H,37,41)(H,38,42)/t23-,24-,25+,28-,29-/m0/s1
InChIKey: UYKAHQIMMZSKPD-PTJPLTMYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Beauveria felina | Beauveria | Cordycipitaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 637.8630000000002
TPSA？: 189.25
MolLogP？: 7.077500000000007
Number of H-Donors: 5
Number of H-Acceptors: 7
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|