CID 10315987

Cyclocommunol

Structural Information

Molecular Formula
C20H16O6
SMILES
CC(=CC1C2=C(C3=C(O1)C=C(C=C3)O)OC4=CC(=CC(=C4C2=O)O)O)C
InChI
InChI=1S/C20H16O6/c1-9(2)5-15-18-19(24)17-13(23)6-11(22)8-16(17)26-20(18)12-4-3-10(21)7-14(12)25-15/h3-8,15,21-23H,1-2H3
InChIKey
VHNPAPHWKVLGHG-UHFFFAOYSA-N
Compound name
3,8,10-trihydroxy-6-(2-methylprop-1-enyl)-6H-chromeno[4,3-b]chromen-7-one
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

5
References

195
Patents

352.0947 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.10198 179.6
[M+Na]+ 375.08392 189.8
[M-H]- 351.08742 184.4
[M+NH4]+ 370.12852 191.6
[M+K]+ 391.05786 187.1
[M+H-H2O]+ 335.09196 172.2
[M+HCOO]- 397.09290 191.8
[M+CH3COO]- 411.10855 190.0
[M+Na-2H]- 373.06937 184.4
[M]+ 352.09415 183.3
[M]- 352.09525 183.3
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

patents stripe