CID 3051209

Fortimicin-d

Structural Information

Molecular Formula
C16H33N5O6
SMILES
CN(C1C(C(C(C(C1OC)O)N)OC2C(CCC(O2)CN)N)O)C(=O)CN
InChI
InChI=1S/C16H33N5O6/c1-21(9(22)6-18)11-13(24)14(10(20)12(23)15(11)25-2)27-16-8(19)4-3-7(5-17)26-16/h7-8,10-16,23-24H,3-6,17-20H2,1-2H3
InChIKey
VYLDQCCRMFPJHA-UHFFFAOYSA-N
Compound name
2-amino-N-[4-amino-3-[3-amino-6-(aminomethyl)oxan-2-yl]oxy-2,5-dihydroxy-6-methoxycyclohexyl]-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

170
Patents

391.24307 Da
Monoisotopic Mass

-4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 392.25035 194.9
[M+Na]+ 414.23229 195.5
[M-H]- 390.23579 198.0
[M+NH4]+ 409.27689 201.9
[M+K]+ 430.20623 196.6
[M+H-H2O]+ 374.24033 186.2
[M+HCOO]- 436.24127 209.0
[M+CH3COO]- 450.25692 237.1
[M+Na-2H]- 412.21774 188.0
[M]+ 391.24252 187.2
[M]- 391.24362 187.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe