CID 134816995

Garciosone h

Structural Information

Molecular Formula
C21H20O8
SMILES
CC1(C=CC2=C(C3=C(C(=C2O1)OC)OC4=C(C3=O)C(=CC(=C4O)OC)OC)O)C
InChI
InChI=1S/C21H20O8/c1-21(2)7-6-9-14(22)13-16(24)12-10(25-3)8-11(26-4)15(23)18(12)28-19(13)20(27-5)17(9)29-21/h6-8,22-23H,1-5H3
InChIKey
NOKJTMTWJHAYKN-UHFFFAOYSA-N
Compound name
5,10-dihydroxy-7,9,12-trimethoxy-2,2-dimethylpyrano[3,2-b]xanthen-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

400.1158 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.12308 190.7
[M+Na]+ 423.10502 203.9
[M-H]- 399.10852 197.9
[M+NH4]+ 418.14962 203.9
[M+K]+ 439.07896 204.0
[M+H-H2O]+ 383.11306 182.3
[M+HCOO]- 445.11400 206.2
[M+CH3COO]- 459.12965 224.6
[M+Na-2H]- 421.09047 197.7
[M]+ 400.11525 203.3
[M]- 400.11635 203.3
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.