CID 44259867

8-c-methylquercetagetin 3,6,7,4'-tetramethyl ether

Structural Information

Molecular Formula
C20H20O8
SMILES
CC1=C2C(=C(C(=C1OC)OC)O)C(=O)C(=C(O2)C3=CC(=C(C=C3)OC)O)OC
InChI
InChI=1S/C20H20O8/c1-9-16-13(14(22)19(26-4)17(9)25-3)15(23)20(27-5)18(28-16)10-6-7-12(24-2)11(21)8-10/h6-8,21-22H,1-5H3
InChIKey
UGQQYSCOGXWBHY-UHFFFAOYSA-N
Compound name
5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxy-8-methylchromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

388.1158 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.12308 187.2
[M+Na]+ 411.10502 198.5
[M-H]- 387.10852 194.9
[M+NH4]+ 406.14962 198.0
[M+K]+ 427.07896 197.9
[M+H-H2O]+ 371.11306 178.6
[M+HCOO]- 433.11400 206.4
[M+CH3COO]- 447.12965 221.5
[M+Na-2H]- 409.09047 189.2
[M]+ 388.11525 198.4
[M]- 388.11635 198.4
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.