CID 14777479

1-hydroxy-3,5-dimethoxy-2,4-diprenylxanthone

Structural Information

Molecular Formula
C25H28O5
SMILES
CC(=CCC1=C(C2=C(C(=C1OC)CC=C(C)C)OC3=C(C2=O)C=CC=C3OC)O)C
InChI
InChI=1S/C25H28O5/c1-14(2)10-12-17-22(27)20-21(26)16-8-7-9-19(28-5)24(16)30-25(20)18(23(17)29-6)13-11-15(3)4/h7-11,27H,12-13H2,1-6H3
InChIKey
KGBJYZXDYBPQGM-UHFFFAOYSA-N
Compound name
1-hydroxy-3,5-dimethoxy-2,4-bis(3-methylbut-2-enyl)xanthen-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

408.19366 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 409.20094 199.1
[M+Na]+ 431.18288 214.1
[M+NH4]+ 426.22748 204.9
[M+K]+ 447.15682 206.8
[M-H]- 407.18638 202.2
[M+Na-2H]- 429.16833 201.6
[M]+ 408.19311 202.2
[M]- 408.19421 202.2
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

patents stripe