CID 44558885

Beta-d-galactosyl-(1->4)-l-rhamnose

Structural Information

Molecular Formula
C12H22O10
SMILES
C[C@H]1[C@@H]([C@H]([C@H](C(O1)O)O)O)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O
InChI
InChI=1S/C12H22O10/c1-3-10(7(16)8(17)11(19)20-3)22-12-9(18)6(15)5(14)4(2-13)21-12/h3-19H,2H2,1H3/t3-,4+,5-,6-,7-,8+,9+,10-,11?,12-/m0/s1
InChIKey
VFLUXFSSKVKHEL-OAAPHKSHSA-N
Compound name
(3R,4S,5R,6S)-6-methyl-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2,3,4-triol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

326.1213 Da
Monoisotopic Mass

-3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.12858 170.9
[M+Na]+ 349.11052 176.4
[M+NH4]+ 344.15512 172.7
[M+K]+ 365.08446 178.2
[M-H]- 325.11402 170.1
[M+Na-2H]- 347.09597 166.3
[M]+ 326.12075 170.6
[M]- 326.12185 170.6
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

patents stripe