CID 10246505

Licoflavone c

Structural Information

Molecular Formula
C20H18O5
SMILES
CC(=CCC1=C2C(=C(C=C1O)O)C(=O)C=C(O2)C3=CC=C(C=C3)O)C
InChI
InChI=1S/C20H18O5/c1-11(2)3-8-14-15(22)9-16(23)19-17(24)10-18(25-20(14)19)12-4-6-13(21)7-5-12/h3-7,9-10,21-23H,8H2,1-2H3
InChIKey
MEHHCBRCXIDGKZ-UHFFFAOYSA-N
Compound name
5,7-dihydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-enyl)chromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

16
References

890
Patents

338.11542 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.12270 178.4
[M+Na]+ 361.10464 187.7
[M-H]- 337.10814 183.9
[M+NH4]+ 356.14924 190.2
[M+K]+ 377.07858 183.4
[M+H-H2O]+ 321.11268 170.8
[M+HCOO]- 383.11362 195.1
[M+CH3COO]- 397.12927 207.7
[M+Na-2H]- 359.09009 180.4
[M]+ 338.11487 181.0
[M]- 338.11597 181.0
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

patents stripe