CID 231412

Fuscaxanthone c

Structural Information

Molecular Formula
C26H30O6
SMILES
CC(=CCC1=C(C=C2C(=C1O)C(=O)C3=C(C(=C(C=C3O2)OC)OC)CC=C(C)C)OC)C
InChI
InChI=1S/C26H30O6/c1-14(2)8-10-16-18(29-5)12-20-23(24(16)27)25(28)22-17(11-9-15(3)4)26(31-7)21(30-6)13-19(22)32-20/h8-9,12-13,27H,10-11H2,1-7H3
InChIKey
FCIKYGUVHWZSJV-UHFFFAOYSA-N
Compound name
1-hydroxy-3,6,7-trimethoxy-2,8-bis(3-methylbut-2-enyl)xanthen-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

19
Patents

438.20422 Da
Monoisotopic Mass

6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 439.211496 207.1
[M+Na]+ 461.193438 216.8
[M-H]- 437.196944 212.7
[M+NH4]+ 456.238043 217.7
[M+K]+ 477.167378 213.8
[M+H-H2O]+ 421.201480 198.7
[M+HCOO]- 483.202421 223.5
[M+CH3COO]- 497.218071 235.8
[M+Na-2H]- 459.178886 206.1
[M]+ 438.20367142 218.7
[M]- 438.20476858 218.7
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