Neoengleromycin
AlkaPlorer ID: AK307562
Synonym: None
IUPAC Name: [3-[3-(dimethylamino)-4-[ethyl(hydroxy)amino]-4-oxobutoxy]-2-hexadecanoyloxypropyl] (9E,12E)-octadeca-9,12-dienoate
Structure
SMILES: CCCCC/C=C/C/C=C/CCCCCCCC(=O)OCC(COCCC(C(=O)N(O)CC)N(C)C)OC(=O)CCCCCCCCCCCCCCC
InChI: InChI=1S/C45H84N2O7/c1-6-9-11-13-15-17-19-21-22-24-25-27-29-31-33-35-43(48)53-40-41(39-52-38-37-42(46(4)5)45(50)47(51)8-3)54-44(49)36-34-32-30-28-26-23-20-18-16-14-12-10-7-2/h15,17,21-22,41-42,51H,6-14,16,18-20,23-40H2,1-5H3/b17-15+,22-21+
InChIKey: UAJNLGQNWWLNNT-DGSHHMFQSA-N
Reference
Neoengleromycin, a Novel Compound from Engleromyces goetzii
PubChem CID: 102246732
CAS: 452064-35-6
LOTUS: LTS0220158
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Engleromyces | Xylariaceae | Xylariales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 765.1739999999993
TPSA？: 105.61
MolLogP？: 11.310799999999992
Number of H-Donors: 1
Number of H-Acceptors: 8
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|