CID 44260023

4'-hydroxy-3,5,8,3'-tetramethoxy-7-prenyloxyflavone

Structural Information

Molecular Formula
C24H26O8
SMILES
CC(=CCOC1=C(C2=C(C(=C1)OC)C(=O)C(=C(O2)C3=CC(=C(C=C3)O)OC)OC)OC)C
InChI
InChI=1S/C24H26O8/c1-13(2)9-10-31-18-12-17(28-4)19-20(26)24(30-6)21(32-23(19)22(18)29-5)14-7-8-15(25)16(11-14)27-3/h7-9,11-12,25H,10H2,1-6H3
InChIKey
WJFJLAXLXSENEO-UHFFFAOYSA-N
Compound name
2-(4-hydroxy-3-methoxyphenyl)-3,5,8-trimethoxy-7-(3-methylbut-2-enoxy)chromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

442.16278 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 443.17006 203.8
[M+Na]+ 465.15200 212.9
[M-H]- 441.15550 211.8
[M+NH4]+ 460.19660 212.7
[M+K]+ 481.12594 212.2
[M+H-H2O]+ 425.16004 194.2
[M+HCOO]- 487.16098 222.4
[M+CH3COO]- 501.17663 233.4
[M+Na-2H]- 463.13745 203.7
[M]+ 442.16223 216.2
[M]- 442.16333 216.2
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.