CID 131752852

(e)-oxyresveratrol 3'-o-b-d-glucoside

Structural Information

Molecular Formula
C20H22O9
SMILES
C1=CC(=C(C=C1O)O)/C=C\C2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O
InChI
InChI=1S/C20H22O9/c21-9-16-17(25)18(26)19(27)20(29-16)28-14-6-10(5-13(23)7-14)1-2-11-3-4-12(22)8-15(11)24/h1-8,16-27H,9H2/b2-1-
InChIKey
GGQVPULXXVQLRT-UPHRSURJSA-N
Compound name
2-[3-[(Z)-2-(2,4-dihydroxyphenyl)ethenyl]-5-hydroxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

406.12637 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 407.13365 194.9
[M+Na]+ 429.11559 204.8
[M+NH4]+ 424.16019 197.4
[M+K]+ 445.08953 202.7
[M-H]- 405.11909 196.6
[M+Na-2H]- 427.10104 195.7
[M]+ 406.12582 196.3
[M]- 406.12692 196.3
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.