CID 10548300

2'-hydroxy-3,7,8,4',5'-pentamethoxyflavone

Structural Information

Molecular Formula
C20H20O8
SMILES
COC1=C(C2=C(C=C1)C(=O)C(=C(O2)C3=CC(=C(C=C3O)OC)OC)OC)OC
InChI
InChI=1S/C20H20O8/c1-23-13-7-6-10-16(22)20(27-5)18(28-17(10)19(13)26-4)11-8-14(24-2)15(25-3)9-12(11)21/h6-9,21H,1-5H3
InChIKey
ILFIBHRYVRDHNZ-UHFFFAOYSA-N
Compound name
2-(2-hydroxy-4,5-dimethoxyphenyl)-3,7,8-trimethoxychromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

388.1158 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.123076 186.6
[M+Na]+ 411.105018 197.6
[M-H]- 387.108524 195.3
[M+NH4]+ 406.149623 197.9
[M+K]+ 427.078958 197.6
[M+H-H2O]+ 371.113060 177.5
[M+HCOO]- 433.114001 207.4
[M+CH3COO]- 447.129651 222.1
[M+Na-2H]- 409.090466 189.8
[M]+ 388.11525142 199.2
[M]- 388.11634858 199.2
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.