Enniatin O3
AlkaPlorer ID: AK054681
Synonym: None
IUPAC Name: (3S,6R,9S,12R,15S,18R)-12-butan-2-yl-17-hydroxy-4,10,16-trimethyl-15-(2-methylpropyl)-3,6,9,18-tetra(propan-2-yl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14-pentone
Structure
SMILES: CCC(C)[C@H]1OC(=O)[C@H](CC(C)C)N(C)C(O)[C@@H](C(C)C)OC(=O)[C@H](C(C)C)N(C)C(=O)[C@@H](C(C)C)OC(=O)[C@H](C(C)C)N(C)C1=O
InChI: InChI=1S/C35H63N3O9/c1-16-23(12)29-32(41)38(15)26(20(6)7)35(44)46-28(22(10)11)31(40)37(14)25(19(4)5)34(43)45-27(21(8)9)30(39)36(13)24(17-18(2)3)33(42)47-29/h18-30,39H,16-17H2,1-15H3/t23?,24-,25-,26-,27+,28+,29+,30?/m0/s1
InChIKey: UBTDCNJVVJEHMG-WFQSNVLJSA-N
Reference
Enniatin Production by the Entomopathogenic Fungus Verticillium hemipterigenum BCC 1449
PubChem CID: 139586786
LOTUS: LTS0097724
{NPAtlas: NPA013315
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Verticillium | Plectosphaerellaceae | Glomerellales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 669.9010000000002
TPSA？: 142.99
MolLogP？: 3.7244000000000055
Number of H-Donors: 1
Number of H-Acceptors: 10
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|