CID 76376878

A-l-arabinofuranosyl-(1->2)-[a-d-mannopyranosyl-(1->6)]-d-mannose

Structural Information

Molecular Formula
C17H30O15
SMILES
C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)O)OC3C(C(C(O3)CO)O)O)O)O)O)O)O)O
InChI
InChI=1S/C17H30O15/c18-1-4-7(20)10(23)13(26)16(30-4)28-3-6-9(22)11(24)14(15(27)29-6)32-17-12(25)8(21)5(2-19)31-17/h4-27H,1-3H2
InChIKey
KXPJZDSXKZWJBT-UHFFFAOYSA-N
Compound name
2-[[5-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3,4,6-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

474.15848 Da
Monoisotopic Mass

-5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 475.16576 210.7
[M+Na]+ 497.14770 210.4
[M-H]- 473.15120 203.3
[M+NH4]+ 492.19230 209.9
[M+K]+ 513.12164 215.2
[M+H-H2O]+ 457.15574 204.0
[M+HCOO]- 519.15668 212.3
[M+CH3COO]- 533.17233 225.1
[M+Na-2H]- 495.13315 229.7
[M]+ 474.15793 204.9
[M]- 474.15903 204.9
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

No patent data available for this compound.