CID 165906

Lipoxamycin

Structural Information

Molecular Formula
C19H36N2O5
SMILES
CC(C)CCCC(=O)CCCCCCC(=O)CCN(C(=O)[C@H](CO)N)O
InChI
InChI=1S/C19H36N2O5/c1-15(2)8-7-11-16(23)9-5-3-4-6-10-17(24)12-13-21(26)19(25)18(20)14-22/h15,18,22,26H,3-14,20H2,1-2H3/t18-/m0/s1
InChIKey
ILLOYMPJYAVZKU-SFHVURJKSA-N
Compound name
(2S)-2-amino-N,3-dihydroxy-N-(14-methyl-3,10-dioxopentadecyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

29
Patents

372.26242 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.26970 198.1
[M+Na]+ 395.25164 197.0
[M-H]- 371.25514 194.2
[M+NH4]+ 390.29624 205.9
[M+K]+ 411.22558 196.4
[M+H-H2O]+ 355.25968 190.4
[M+HCOO]- 417.26062 198.7
[M+CH3COO]- 431.27627 225.1
[M+Na-2H]- 393.23709 190.1
[M]+ 372.26187 200.7
[M]- 372.26297 200.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe