CID 14630682

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

Structural Information

Molecular Formula
C20H20O8
SMILES
COC1=CC2=C(C(=C1)OC)C(=O)C(=C(O2)C3=CC(=C(C=C3OC)OC)O)OC
InChI
InChI=1S/C20H20O8/c1-23-10-6-15(26-4)17-16(7-10)28-19(20(27-5)18(17)22)11-8-12(21)14(25-3)9-13(11)24-2/h6-9,21H,1-5H3
InChIKey
FEPHVCACIOGMKO-UHFFFAOYSA-N
Compound name
2-(5-hydroxy-2,4-dimethoxyphenyl)-3,5,7-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]+ 389.12308 186.6
[M+Na]+ 411.10502 197.6
[M-H]- 387.10852 195.3
[M+NH4]+ 406.14962 197.9
[M+K]+ 427.07896 197.6
[M+H-H2O]+ 371.11306 177.5
[M+HCOO]- 433.11400 207.4
[M+CH3COO]- 447.12965 222.1
[M+Na-2H]- 409.09047 189.8
[M]+ 388.11525 199.2
[M]- 388.11635 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.