Structure Database (LMSD)

Common Name
Chaetomadramine D
Systematic Name
N-α-myristoyl-N-δ-anhydromevalonyl-Nδ-hydroxy-omithine methyl ester
Synonyms
LM ID
LMFA08020452
Formula
C26H48N2O6
Exact Mass
Calculate m/z
484.351238
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty amides [FA08]
N-acyl amines [FA0802]

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Chaetomium madrasense (#1036254)
Sordariomycetes (#147550)
Chaetomadramines A-E, a class of siderophores with potent neuroprotective activity from the fungus Chaetomium madrasense cib-1.,
Fitoterapia, 2023
Pubmed ID: 36375689

String Representations

InChiKey (Click to copy)
GDRSNHZJNCDSNY-VATLKHLZSA-N
InChi (Click to copy)
InChI=1S/C26H48N2O6/c1-4-5-6-7-8-9-10-11-12-13-14-17-24(30)27-23(26(32)34-3)16-15-19-28(33)25(31)21-22(2)18-20-29/h21,23,29,33H,4-20H2,1-3H3,(H,27,30)/b22-21+/t23-/m0/s1
SMILES (Click to copy)
N(C(=O)CCCCCCCCCCCCC)[C@H](C(=O)OC)CCCN(C(/C=C(/CCO)\C)=O)O

Calculated Physicochemical Properties

Heavy Atoms 34
Rings
Aromatic Rings
Rotatable Bonds 22
Van der Waals Molecular Volume 522.54
Topological Polar Surface Area 116.17
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 8
logP 5.70
Molar Refractivity 134.57

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Created at
21st Feb 2025
Updated at
21st Feb 2025