CID 42608012

5,7-dihydroxy-3',4'-dimethoxy-5'-prenylflavanone

Structural Information

Molecular Formula
C22H24O6
SMILES
CC(=CCC1=C(C(=CC(=C1)C2CC(=O)C3=C(C=C(C=C3O2)O)O)OC)OC)C
InChI
InChI=1S/C22H24O6/c1-12(2)5-6-13-7-14(8-20(26-3)22(13)27-4)18-11-17(25)21-16(24)9-15(23)10-19(21)28-18/h5,7-10,18,23-24H,6,11H2,1-4H3
InChIKey
LMJYCCOYYJEVOW-UHFFFAOYSA-N
Compound name
2-[3,4-dimethoxy-5-(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

384.1573 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.16458 191.1
[M+Na]+ 407.14652 204.2
[M+NH4]+ 402.19112 196.6
[M+K]+ 423.12046 198.6
[M-H]- 383.15002 194.8
[M+Na-2H]- 405.13197 193.9
[M]+ 384.15675 193.9
[M]- 384.15785 193.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe