CID 44260024

5,7-dihydroxy-3,8,3'-trimethoxy-4'-prenyloxyflavone

Structural Information

Molecular Formula
C23H24O8
SMILES
CC(=CCOC1=C(C=C(C=C1)C2=C(C(=O)C3=C(O2)C(=C(C=C3O)O)OC)OC)OC)C
InChI
InChI=1S/C23H24O8/c1-12(2)8-9-30-16-7-6-13(10-17(16)27-3)20-23(29-5)19(26)18-14(24)11-15(25)21(28-4)22(18)31-20/h6-8,10-11,24-25H,9H2,1-5H3
InChIKey
JBGSDQZIBUGNCO-UHFFFAOYSA-N
Compound name
5,7-dihydroxy-3,8-dimethoxy-2-[3-methoxy-4-(3-methylbut-2-enoxy)phenyl]chromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

428.14713 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 429.15441 199.6
[M+Na]+ 451.13635 208.7
[M-H]- 427.13985 206.4
[M+NH4]+ 446.18095 208.4
[M+K]+ 467.11029 207.5
[M+H-H2O]+ 411.14439 190.5
[M+HCOO]- 473.14533 217.0
[M+CH3COO]- 487.16098 228.5
[M+Na-2H]- 449.12180 199.6
[M]+ 428.14658 210.0
[M]- 428.14768 210.0
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.