Structure Database (LMSD)

Common Name
Serratamic acid
Systematic Name
N-(3S-hydroxydecanoyl)-L-serine
Synonyms
LM ID
LMFA00000002
Formula
C13H25NO5
Exact Mass
Calculate m/z
275.173274
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Other Fatty Acyls [FA00]
Fatty Acids and Conjugates [FA01]
Hydroxy fatty acids [FA0105]

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Serratia (#613)
Gammaproteobacteria (#1236)
Serratamic acid, a derivative of L-serine produced by organisms of the Serratia group.,
Biochem J, 1955
Pubmed ID: 14389230

String Representations

InChiKey (Click to copy)
NDDJIMSGSZNACM-QWRGUYRKSA-N
InChi (Click to copy)
InChI=1S/C13H25NO5/c1-2-3-4-5-6-7-10(16)8-12(17)14-11(9-15)13(18)19/h10-11,15-16H,2-9H2,1H3,(H,14,17)(H,18,19)/t10-,11-/m0/s1
SMILES (Click to copy)
C(O)[C@](C(=O)O)([H])NC(C[C@@H](O)CCCCCCC)=O

Other Databases

CHEBI ID
137783
PubChem CID
42607281

Calculated Physicochemical Properties

Heavy Atoms 19
Rings 0
Aromatic Rings 0
Rotatable Bonds 11
Van der Waals Molecular Volume 283.13
Topological Polar Surface Area 106.86
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 6
logP 1.52
Molar Refractivity 72.17

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Updated at
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