MeFSAT
Me
dicinal
F
ungi
S
econdary metabolites
A
nd
T
herapeutics
Home
Basic search
Advanced search
Statistics
Acknowledgement
Download
Help
Secondary metabolite: Neoengleromycin
Summary
Physicochemical properties
Drug-likeness properties
ADMET properties
Descriptors
Summary
Molecular formula:
C45H84N2O7
SMILES:
CCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCC/C=C/C/C=C/CCCCC)COCCC(C(=O)N(CC)O)N(C)C
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
Chemical classification
Kingdom:
Organic compounds
Super class:
Lipids and lipid-like molecules
Class:
Fatty Acyls
Sub class:
Lineolic acids and derivatives
Synonymous chemical names:
neoengleromycin
External chemical identifiers:
CID_102246732
Chemical structure download
2D:
2D MOL
2D MOL2
2D SDF
3D:
3D MOL
3D MOL2
3D SDF
3D PDB
3D PDBQT
TOP
Designed by
R.P. Vivek-Ananth
, M Karthikeyan and Ajaya Kumar Sahoo