CID 11153672

Cudratricusxanthone a

Structural Information

Molecular Formula
C23H24O6
SMILES
CC(=CCC1=C(C(=CC2=C1C(=O)C3=C(O2)C(=C(C=C3O)O)C(C)(C)C=C)O)O)C
InChI
InChI=1S/C23H24O6/c1-6-23(4,5)19-14(25)9-13(24)18-21(28)17-12(8-7-11(2)3)20(27)15(26)10-16(17)29-22(18)19/h6-7,9-10,24-27H,1,8H2,2-5H3
InChIKey
FUEJTEBWTNXAPG-UHFFFAOYSA-N
Compound name
2,3,6,8-tetrahydroxy-5-(2-methylbut-3-en-2-yl)-1-(3-methylbut-2-enyl)xanthen-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

20
References

82
Patents

396.1573 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 397.16458 194.8
[M+Na]+ 419.14652 208.4
[M+NH4]+ 414.19112 199.1
[M+K]+ 435.12046 203.7
[M-H]- 395.15002 195.6
[M+Na-2H]- 417.13197 195.6
[M]+ 396.15675 196.9
[M]- 396.15785 196.9
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