CID 42608025

Heteroflavanone c

Structural Information

Molecular Formula
C23H26O7
SMILES
CC(=CCC1=C2C(=C(C=C1O)O)C(=O)CC(O2)C3=C(C=C(C=C3OC)OC)OC)C
InChI
InChI=1S/C23H26O7/c1-12(2)6-7-14-15(24)10-16(25)21-17(26)11-20(30-23(14)21)22-18(28-4)8-13(27-3)9-19(22)29-5/h6,8-10,20,24-25H,7,11H2,1-5H3
InChIKey
LKUWYFZLCAUAGB-UHFFFAOYSA-N
Compound name
5,7-dihydroxy-8-(3-methylbut-2-enyl)-2-(2,4,6-trimethoxyphenyl)-2,3-dihydrochromen-4-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

414.16785 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 415.17513 198.4
[M+Na]+ 437.15707 211.1
[M+NH4]+ 432.20167 203.1
[M+K]+ 453.13101 206.1
[M-H]- 413.16057 201.6
[M+Na-2H]- 435.14252 200.3
[M]+ 414.16730 201.0
[M]- 414.16840 201.0
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.