Structure Database (LMSD)

Common Name
Bacillamidin G
Systematic Name
15-methyl-heptadecamide
Synonyms
LM ID
LMFA08010030
Formula
C18H37NO
Exact Mass
Calculate m/z
283.287514
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty amides [FA08]
Primary amides [FA0801]

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Bacillus pumilus (#1408)
Bacilli (#91061)
Bacillamidins A⁻G from a Marine-Derived Bacillus pumilus.,
Mar Drugs, 2018
Pubmed ID: 30208577

String Representations

InChiKey (Click to copy)
RRNKVONILTZEAA-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C18H37NO/c1-3-17(2)15-13-11-9-7-5-4-6-8-10-12-14-16-18(19)20/h17H,3-16H2,1-2H3,(H2,19,20)
SMILES (Click to copy)
C(CCCCCCCCCCCCCC(C)CC)(=O)N

Other Databases

PubChem CID
171119365

Calculated Physicochemical Properties

Heavy Atoms 20
Rings 0
Aromatic Rings 0
Rotatable Bonds 15
Van der Waals Molecular Volume 337.11
Topological Polar Surface Area 43.09
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 5.59
Molar Refractivity 88.67

Admin

Created at
11th Oct 2020
Updated at
11th Oct 2020