CID 25202590

Alpha-d-xylosyl-(1->6)-beta-d-glucosyl- (1->4)-beta-d-glucose

Structural Information

Molecular Formula
C17H30O15
SMILES
C1[C@H]([C@@H]([C@H]([C@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)O[C@@H]3[C@H](O[C@H]([C@@H]([C@H]3O)O)O)CO)O)O)O)O)O)O
InChI
InChI=1S/C17H30O15/c18-1-5-14(10(23)11(24)15(27)30-5)32-17-13(26)9(22)8(21)6(31-17)3-29-16-12(25)7(20)4(19)2-28-16/h4-27H,1-3H2/t4-,5-,6-,7+,8-,9+,10-,11-,12-,13-,14-,15-,16-,17+/m1/s1
InChIKey
BSCUNSVAACYEAI-CHIDMJEYSA-N
Compound name
(2R,3R,4R,5S,6R)-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxyoxane-2,3,4-triol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1
Patents

474.15848 Da
Monoisotopic Mass

-6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 475.16576 208.4
[M+Na]+ 497.14770 207.5
[M+NH4]+ 492.19230 206.9
[M+K]+ 513.12164 212.9
[M-H]- 473.15120 199.3
[M+Na-2H]- 495.13315 225.0
[M]+ 474.15793 204.6
[M]- 474.15903 204.6
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

No patent data available for this compound.